메뉴 건너뛰기




Volumn 48, Issue 5, 2014, Pages 3074-3083

Chemometrics-assisted effect-directed analysis of crude and refined oil using comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIZATION; BIOASSAY; CHROMATOGRAPHY; COMPUTATIONAL CHEMISTRY; MASS SPECTROMETRY; SMOKE DETECTORS;

EID: 84895524758     PISSN: 0013936X     EISSN: 15205851     Source Type: Journal    
DOI: 10.1021/es404859m     Document Type: Article
Times cited : (35)

References (42)
  • 2
    • 84880128631 scopus 로고    scopus 로고
    • Expansion of the analytical window for oil spill characterization by ultrahigh resolution mass spectrometry: Beyond gas chromatography
    • McKenna, A. M.; Nelson, R. K.; Reddy, C. M.; Savory, J. J.; Kaiser, N. K.; Fitzsimmons, J. E.; Marshall, A. G.; Rodgers, R. P. Expansion of the analytical window for oil spill characterization by ultrahigh resolution mass spectrometry: beyond gas chromatography Environ. Sci. Technol. 2013, 47 (13) 7530-7539
    • (2013) Environ. Sci. Technol. , vol.47 , Issue.13 , pp. 7530-7539
    • McKenna, A.M.1    Nelson, R.K.2    Reddy, C.M.3    Savory, J.J.4    Kaiser, N.K.5    Fitzsimmons, J.E.6    Marshall, A.G.7    Rodgers, R.P.8
  • 3
    • 84869870489 scopus 로고    scopus 로고
    • Evaluation of artificially-weathered standard fuel oil toxicity by marine invertebrate embryogenesis bioassays
    • Bellas, J.; Saco-álvarez, L.; Nieto, T.; Bayona, J. M.; Albaigés, J.; Beiras, R. Evaluation of artificially-weathered standard fuel oil toxicity by marine invertebrate embryogenesis bioassays Chemosphere 2013, 90 (3) 1103-1108
    • (2013) Chemosphere , vol.90 , Issue.3 , pp. 1103-1108
    • Bellas, J.1    Saco-Álvarez, L.2    Nieto, T.3    Bayona, J.M.4    Albaigés, J.5    Beiras, R.6
  • 4
    • 33745119570 scopus 로고    scopus 로고
    • Weathering and toxicity of marine sediments contaminated with oils and polycyclic aromatic hydrocarbons
    • Jonker, M. T. O.; Brils, J. M.; Sinke, A. J. C.; Murk, A. J.; Koelmans, A. A. Weathering and toxicity of marine sediments contaminated with oils and polycyclic aromatic hydrocarbons Environ. Toxicol. Chem. 2006, 25 (5) 1345-1353
    • (2006) Environ. Toxicol. Chem. , vol.25 , Issue.5 , pp. 1345-1353
    • Jonker, M.T.O.1    Brils, J.M.2    Sinke, A.J.C.3    Murk, A.J.4    Koelmans, A.A.5
  • 5
    • 77955892293 scopus 로고    scopus 로고
    • A guide to toxicity assessment and monitoring effects at lower levels of biological organization following marine oil spills in European waters
    • Martínez-Gómez, C.; Vethaak, A. D.; Hylland, K.; Burgeot, T.; Köhler, A.; Lyons, B. P.; Thain, J.; Gubbins, M. J.; Davies, I. M. A guide to toxicity assessment and monitoring effects at lower levels of biological organization following marine oil spills in European waters ICES J. Mar. Sci. 2010, 67 (6) 1105-1118
    • (2010) ICES J. Mar. Sci. , vol.67 , Issue.6 , pp. 1105-1118
    • Martínez-Gómez, C.1    Vethaak, A.D.2    Hylland, K.3    Burgeot, T.4    Köhler, A.5    Lyons, B.P.6    Thain, J.7    Gubbins, M.J.8    Davies, I.M.9
  • 6
    • 28344455694 scopus 로고    scopus 로고
    • Polycyclic aromatic hydrocarbon (PAH) ecotoxicology in marine ecosystems
    • Hylland, K. Polycyclic aromatic hydrocarbon (PAH) ecotoxicology in marine ecosystems J. Toxicol. Environ. Health, Part A 2006, 69 (1-2) 109-123
    • (2006) J. Toxicol. Environ. Health, Part A , vol.69 , Issue.12 , pp. 109-123
    • Hylland, K.1
  • 8
    • 84856694587 scopus 로고    scopus 로고
    • Effect-directed assessment of the bioaccumulation potential and chemical nature of A h receptor agonists in crude and refined oils
    • Vrabie, C. M.; Sinnige, T. L.; Murk, A. J.; Jonker, M. T. O. Effect-directed assessment of the bioaccumulation potential and chemical nature of A h receptor agonists in crude and refined oils Environ. Sci. Technol. 2012, 46 (3) 1572-1580
    • (2012) Environ. Sci. Technol. , vol.46 , Issue.3 , pp. 1572-1580
    • Vrabie, C.M.1    Sinnige, T.L.2    Murk, A.J.3    Jonker, M.T.O.4
  • 9
    • 77449090892 scopus 로고    scopus 로고
    • Assessing relationships between chemical exposure, parasite infection, fish health, and fish ecological status: A case study using chub (Leuciscus cephalus) in the Balina River, Czech Republic
    • Wenger, M.; Ondračková, M.; Machala, M.; Neča, J.; Hyršl, P.; Šimková, A.; Jurajda, P.; Von Der Ohe, P.; Segner, H. Assessing relationships between chemical exposure, parasite infection, fish health, and fish ecological status: A case study using chub (Leuciscus cephalus) in the Balina River, Czech Republic Environ. Toxicol. Chem. 2010, 29 (2) 453-466
    • (2010) Environ. Toxicol. Chem. , vol.29 , Issue.2 , pp. 453-466
    • Wenger, M.1    Ondračková, M.2    MacHala, M.3    Neča, J.4    Hyršl, P.5    Šimková, A.6    Jurajda, P.7    Von Der Ohe, P.8    Segner, H.9
  • 10
    • 70350767354 scopus 로고    scopus 로고
    • Effect-directed identification of naphthenic acids as important in vitro xeno-estrogens and anti-androgens in North Sea offshore produced water discharges
    • Thomas, K. V.; Langford, K.; Petersen, K.; Smith, A. J.; Tollefsen, K. E. Effect-directed identification of naphthenic acids as important in vitro xeno-estrogens and anti-androgens in North Sea offshore produced water discharges Environ. Sci. Technol. 2009, 43 (21) 8066-8071
    • (2009) Environ. Sci. Technol. , vol.43 , Issue.21 , pp. 8066-8071
    • Thomas, K.V.1    Langford, K.2    Petersen, K.3    Smith, A.J.4    Tollefsen, K.E.5
  • 11
    • 3242773104 scopus 로고    scopus 로고
    • Effect-directed analysis: A promising tool for the identification of organic toxicants in complex mixtures?
    • Brack, W. Effect-directed analysis: A promising tool for the identification of organic toxicants in complex mixtures? Anal. Bioanal. Chem. 2003, 377 (3) 397-407
    • (2003) Anal. Bioanal. Chem. , vol.377 , Issue.3 , pp. 397-407
    • Brack, W.1
  • 12
    • 77956185903 scopus 로고    scopus 로고
    • Compound class oil fingerprinting techniques using comprehensive two-dimensional gas chromatography (GC × GC)
    • Ventura, G. T.; Raghuraman, B.; Nelson, R. K.; Mullins, O. C.; Reddy, C. M. Compound class oil fingerprinting techniques using comprehensive two-dimensional gas chromatography (GC × GC) Org. Geochem. 2010, 41 (9) 1026-1035
    • (2010) Org. Geochem. , vol.41 , Issue.9 , pp. 1026-1035
    • Ventura, G.T.1    Raghuraman, B.2    Nelson, R.K.3    Mullins, O.C.4    Reddy, C.M.5
  • 13
    • 54849195200 scopus 로고    scopus 로고
    • Disentangling oil weathering at a marine seep using GC × GC: Broad metabolic specificity accompanies subsurface petroleum biodegradation
    • Wardlaw, G. D.; Arey, J. S.; Reddy, C. M.; Nelson, R. K.; Ventura, G. T.; Valentine, D. L. Disentangling oil weathering at a marine seep using GC × GC: Broad metabolic specificity accompanies subsurface petroleum biodegradation Environ. Sci. Technol. 2008, 42 (19) 7166-7173
    • (2008) Environ. Sci. Technol. , vol.42 , Issue.19 , pp. 7166-7173
    • Wardlaw, G.D.1    Arey, J.S.2    Reddy, C.M.3    Nelson, R.K.4    Ventura, G.T.5    Valentine, D.L.6
  • 14
    • 37349048092 scopus 로고    scopus 로고
    • High-performance liquid chromatography fractionation using a silver-modified column followed by two-dimensional comprehensive gas chromatography for detailed group-type characterization of oils and oil pollutions
    • Mao, D.; Van De Weghe, H.; Diels, L.; De Brucker, N.; Lookman, R.; Vanermen, G. High-performance liquid chromatography fractionation using a silver-modified column followed by two-dimensional comprehensive gas chromatography for detailed group-type characterization of oils and oil pollutions J. Chromatogr., A 2008, 1179 (1) 33-40
    • (2008) J. Chromatogr., A , vol.1179 , Issue.1 , pp. 33-40
    • Mao, D.1    Van De Weghe, H.2    Diels, L.3    De Brucker, N.4    Lookman, R.5    Vanermen, G.6
  • 15
    • 0034260328 scopus 로고    scopus 로고
    • Comprehensive two-dimensional gas chromatography and chemometrics for the high-speed quantitative analysis of aromatic isomers in a jet fuel using the standard addition method and an objective retention time alignment algorithm
    • Fraga, C. G.; Prazen, B. J.; Synovec, R. E. Comprehensive two-dimensional gas chromatography and chemometrics for the high-speed quantitative analysis of aromatic isomers in a jet fuel using the standard addition method and an objective retention time alignment algorithm Anal. Chem. 2000, 72 (17) 4154-4162
    • (2000) Anal. Chem. , vol.72 , Issue.17 , pp. 4154-4162
    • Fraga, C.G.1    Prazen, B.J.2    Synovec, R.E.3
  • 16
    • 51549097968 scopus 로고    scopus 로고
    • Automated resolution of nontarget analyte signals in GC × GC-TOFMS data using parallel factor analysis
    • Hoggard, J. C.; Synovec, R. E. Automated resolution of nontarget analyte signals in GC × GC-TOFMS data using parallel factor analysis Anal. Chem. 2008, 80 (17) 6677-6688
    • (2008) Anal. Chem. , vol.80 , Issue.17 , pp. 6677-6688
    • Hoggard, J.C.1    Synovec, R.E.2
  • 17
    • 83655164810 scopus 로고    scopus 로고
    • Resolution and quantification of complex mixtures of polycyclic aromatic hydrocarbons in heavy fuel oil sample by means of GC × GC-TOFMS combined to multivariate curve resolution
    • Parastar, H.; Radović, J. R.; Jalali-Heravi, M.; Diez, S.; Bayona, J. M.; Tauler, R. Resolution and quantification of complex mixtures of polycyclic aromatic hydrocarbons in heavy fuel oil sample by means of GC × GC-TOFMS combined to multivariate curve resolution Anal. Chem. 2011, 83 (24) 9289-9297
    • (2011) Anal. Chem. , vol.83 , Issue.24 , pp. 9289-9297
    • Parastar, H.1    Radović, J.R.2    Jalali-Heravi, M.3    Diez, S.4    Bayona, J.M.5    Tauler, R.6
  • 18
    • 0003009442 scopus 로고    scopus 로고
    • Multiway calibration. Multilinear PLS
    • Bro, R. Multiway calibration. Multilinear PLS J. Chemom. 1996, 10 (1) 47-61
    • (1996) J. Chemom. , vol.10 , Issue.1 , pp. 47-61
    • Bro, R.1
  • 19
    • 0035577927 scopus 로고    scopus 로고
    • Two-dimensional gas chromatography and trilinear partial least squares for the quantitative analysis of aromatic and naphthene, content in naphtha
    • Prazen, B. J.; Johnson, K. J.; Weber, A.; Synovec, R. E. Two-dimensional gas chromatography and trilinear partial least squares for the quantitative analysis of aromatic and naphthene, content in naphtha Anal. Chem. 2001, 73 (23) 5677-5682
    • (2001) Anal. Chem. , vol.73 , Issue.23 , pp. 5677-5682
    • Prazen, B.J.1    Johnson, K.J.2    Weber, A.3    Synovec, R.E.4
  • 20
    • 47549092735 scopus 로고    scopus 로고
    • Identification of gasoline adulteration using comprehensive two-dimensional gas chromatography combined to multivariate data processing
    • Pedroso, M. P.; de Godoy, L. A. F.; Ferreira, E. C.; Poppi, R. J.; Augusto, F. Identification of gasoline adulteration using comprehensive two-dimensional gas chromatography combined to multivariate data processing J. Chromatogr., A 2008, 1201 (2) 176-182
    • (2008) J. Chromatogr., A , vol.1201 , Issue.2 , pp. 176-182
    • Pedroso, M.P.1    De Godoy, L.A.F.2    Ferreira, E.C.3    Poppi, R.J.4    Augusto, F.5
  • 21
    • 47549118647 scopus 로고    scopus 로고
    • Quantification of kerosene in gasoline by comprehensive two-dimensional gas chromatography and N -way multivariate analysis
    • De Godoy, L. A. F.; Ferreira, E. C.; Pedroso, M. P.; Fidélis, C. H. D. V.; Augusto, F.; Poppi, R. J. Quantification of kerosene in gasoline by comprehensive two-dimensional gas chromatography and N -way multivariate analysis Anal. Lett. 2008, 41 (9) 1603-1614
    • (2008) Anal. Lett. , vol.41 , Issue.9 , pp. 1603-1614
    • De Godoy, L.A.F.1    Ferreira, E.C.2    Pedroso, M.P.3    Fidélis, C.H.D.V.4    Augusto, F.5    Poppi, R.J.6
  • 22
    • 2342442319 scopus 로고    scopus 로고
    • Quantification of naphthalenes in jet fuel with GC × GC/Tri-PLS and windowed rank minimization retention time alignment
    • Johnson, K. J.; Prazen, B. J.; Young, D. C.; Synovec, R. E. Quantification of naphthalenes in jet fuel with GC × GC/Tri-PLS and windowed rank minimization retention time alignment J. Sep. Sci. 2004, 27 (5-6) 410-416
    • (2004) J. Sep. Sci. , vol.27 , Issue.56 , pp. 410-416
    • Johnson, K.J.1    Prazen, B.J.2    Young, D.C.3    Synovec, R.E.4
  • 23
    • 84870901476 scopus 로고    scopus 로고
    • Compositional properties characterizing commonly transported oils and controlling their fate in the marine environment
    • Radović, J. R.; Dominguez, C.; Laffont, K.; Diez, S.; Readman, J. W.; Albaiges, J.; Bayona, J. M. Compositional properties characterizing commonly transported oils and controlling their fate in the marine environment J. Environ. Monit. 2012, 14 (12) 3220-3229
    • (2012) J. Environ. Monit. , vol.14 , Issue.12 , pp. 3220-3229
    • Radović, J.R.1    Dominguez, C.2    Laffont, K.3    Diez, S.4    Readman, J.W.5    Albaiges, J.6    Bayona, J.M.7
  • 25
    • 84878667853 scopus 로고    scopus 로고
    • Effects of simulated weathering on the toxicity of selected crude oils and their components to sea urchin embryos
    • Rial, D.; Radović, J. R.; Bayona, J. M.; Macrae, K.; Thomas, K. V.; Beiras, R. Effects of simulated weathering on the toxicity of selected crude oils and their components to sea urchin embryos J. Haz. Mater. 2013, 260 (0) 67-73
    • (2013) J. Haz. Mater. , vol.260 , Issue.0 , pp. 67-73
    • Rial, D.1    Radović, J.R.2    Bayona, J.M.3    MacRae, K.4    Thomas, K.V.5    Beiras, R.6
  • 26
    • 0033622929 scopus 로고    scopus 로고
    • Diamondoid hydrocarbon ratios as indicators of biodegradation in Australian crude oils
    • Grice, K.; Alexander, R.; Kagi, R. I. Diamondoid hydrocarbon ratios as indicators of biodegradation in Australian crude oils Org. Geochem. 2000, 31 (1) 67-73
    • (2000) Org. Geochem. , vol.31 , Issue.1 , pp. 67-73
    • Grice, K.1    Alexander, R.2    Kagi, R.I.3
  • 27
    • 0025479443 scopus 로고
    • Characterization of north sea petroleum fractions: Aromatic ring class distribution
    • Rønningsen, H. P.; Skjevrak, I. Characterization of north sea petroleum fractions: Aromatic ring class distribution Energy Fuels 1990, 4 (5) 608-626
    • (1990) Energy Fuels , vol.4 , Issue.5 , pp. 608-626
    • Rønningsen, H.P.1    Skjevrak, I.2
  • 28
    • 36949038231 scopus 로고    scopus 로고
    • Retention characteristics of aromatic hydrocarbons on silica and aminopropyl-modified monolithic columns in normal-phase HPLC
    • Sutton, P. A.; Nesterenko, P. N. Retention characteristics of aromatic hydrocarbons on silica and aminopropyl-modified monolithic columns in normal-phase HPLC J. Sep. Sci. 2007, 30 (17) 2900-2909
    • (2007) J. Sep. Sci. , vol.30 , Issue.17 , pp. 2900-2909
    • Sutton, P.A.1    Nesterenko, P.N.2
  • 30
    • 84886936579 scopus 로고    scopus 로고
    • PAH-CALUX, an optimized bioassay for AhR-mediated hazard identification of polycyclic aromatic hydrocarbons (PAHs) as individual compounds and in complex mixtures
    • Pieterse, B.; Felzel, E.; Winter, R.; Van Der Burg, B.; Brouwer, A. PAH-CALUX, an optimized bioassay for AhR-mediated hazard identification of polycyclic aromatic hydrocarbons (PAHs) as individual compounds and in complex mixtures Environ. Sci. Technol. 2013, 47 (20) 11651-11659
    • (2013) Environ. Sci. Technol. , vol.47 , Issue.20 , pp. 11651-11659
    • Pieterse, B.1    Felzel, E.2    Winter, R.3    Van Der Burg, B.4    Brouwer, A.5
  • 31
    • 0031656115 scopus 로고    scopus 로고
    • Several environmental oestrogens are also anti-androgens
    • Sohoni, P.; Sumpter, J. P. Several environmental oestrogens are also anti-androgens J. Endocrinol. 1998, 158 (3) 327-339
    • (1998) J. Endocrinol. , vol.158 , Issue.3 , pp. 327-339
    • Sohoni, P.1    Sumpter, J.P.2
  • 32
    • 84860999989 scopus 로고    scopus 로고
    • VirtualToxLab - A platform for estimating the toxic potential of drugs, chemicals and natural products
    • Vedani, A.; Dobler, M.; Smiesko, M. VirtualToxLab-A platform for estimating the toxic potential of drugs, chemicals and natural products Toxicol. Appl. Pharmacol. 2012, 261 (2) 142-153
    • (2012) Toxicol. Appl. Pharmacol. , vol.261 , Issue.2 , pp. 142-153
    • Vedani, A.1    Dobler, M.2    Smiesko, M.3
  • 33
    • 77950317860 scopus 로고    scopus 로고
    • Specific in vitro toxicity of crude and refined petroleum products. 1. Aryl hydrocarbon receptor-mediated responses
    • Vrabie, C. M.; Jonker, M. T. O.; Murk, A. J. Specific in vitro toxicity of crude and refined petroleum products. 1. Aryl hydrocarbon receptor-mediated responses Environ. Toxicol. Chem. 2009, 28 (9) 1995-2003
    • (2009) Environ. Toxicol. Chem. , vol.28 , Issue.9 , pp. 1995-2003
    • Vrabie, C.M.1    Jonker, M.T.O.2    Murk, A.J.3
  • 36
    • 33847284865 scopus 로고    scopus 로고
    • Estrogen receptor (ER) agonists and androgen receptor (AR) antagonists in effluents from Norwegian North Sea oil production platforms
    • Tollefsen, K. E.; Harman, C.; Smith, A.; Thomas, K. V. Estrogen receptor (ER) agonists and androgen receptor (AR) antagonists in effluents from Norwegian North Sea oil production platforms Mar. Pollut. Bull. 2007, 54 (3) 277-283
    • (2007) Mar. Pollut. Bull. , vol.54 , Issue.3 , pp. 277-283
    • Tollefsen, K.E.1    Harman, C.2    Smith, A.3    Thomas, K.V.4
  • 37
    • 0037670381 scopus 로고    scopus 로고
    • A role of aryl hydrocarbon receptor in the antiandrogenic effects of polycyclic aromatic hydrocarbons in LNCaP human prostate carcinoma cells
    • Kizu, R.; Okamura, K.; Toriba, A.; Kakishima, H.; Mizokami, A.; Burnstein, K. L.; Hayakawa, K. A role of aryl hydrocarbon receptor in the antiandrogenic effects of polycyclic aromatic hydrocarbons in LNCaP human prostate carcinoma cells Arch. Toxicol. 2003, 77 (6) 335-343
    • (2003) Arch. Toxicol. , vol.77 , Issue.6 , pp. 335-343
    • Kizu, R.1    Okamura, K.2    Toriba, A.3    Kakishima, H.4    Mizokami, A.5    Burnstein, K.L.6    Hayakawa, K.7
  • 38
    • 29744470543 scopus 로고    scopus 로고
    • Measurement of total polycyclic aromatic hydrocarbon concentrations in sediments and toxic units used for estimating risk to benthic invertebrates at manufactured gas plant sites
    • Hawthorne, S. B.; Miller, D. J.; Kreitinger, J. P. Measurement of total polycyclic aromatic hydrocarbon concentrations in sediments and toxic units used for estimating risk to benthic invertebrates at manufactured gas plant sites Environ. Toxicol. Chem. 2006, 25 (1) 287-296
    • (2006) Environ. Toxicol. Chem. , vol.25 , Issue.1 , pp. 287-296
    • Hawthorne, S.B.1    Miller, D.J.2    Kreitinger, J.P.3
  • 39
    • 26844568730 scopus 로고    scopus 로고
    • Effects of the polycyclic aromatic hydrocarbon heterocycles, carbazole and dibenzothiophene, on in vivo and in vitro CYP1A activity and polycyclic aromatic hydrocarbon-derived embryonic deformities
    • Wassenberg, D. M.; Nerlinger, A. L.; Battle, L. P.; Di Giulio, R. T. Effects of the polycyclic aromatic hydrocarbon heterocycles, carbazole and dibenzothiophene, on in vivo and in vitro CYP1A activity and polycyclic aromatic hydrocarbon-derived embryonic deformities Environ. Toxicol. Chem. 2005, 24 (10) 2526-2532
    • (2005) Environ. Toxicol. Chem. , vol.24 , Issue.10 , pp. 2526-2532
    • Wassenberg, D.M.1    Nerlinger, A.L.2    Battle, L.P.3    Di Giulio, R.T.4
  • 41
    • 84880131414 scopus 로고    scopus 로고
    • Solving chromatographic challenges in comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry using multivariate curve resolution-alternating least squares ABC Highlights: Authored by rising stars and top experts
    • Parastar, H.; Radović, J. R.; Bayona, J. M.; Tauler, R. Solving chromatographic challenges in comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry using multivariate curve resolution-alternating least squares ABC Highlights: authored by rising stars and top experts Anal. Bioanal. Chem. 2013, 405 (19) 6235-6249
    • (2013) Anal. Bioanal. Chem. , vol.405 , Issue.19 , pp. 6235-6249
    • Parastar, H.1    Radović, J.R.2    Bayona, J.M.3    Tauler, R.4
  • 42
    • 33846863356 scopus 로고    scopus 로고
    • Effect-directed analysis of key toxicants in european river basins. A review
    • Barceló, D. Effect-directed analysis of key toxicants in european river basins. A review Environ. Sci. Pollut. Res. Int. 2007, 14 (1) 30-38
    • (2007) Environ. Sci. Pollut. Res. Int. , vol.14 , Issue.1 , pp. 30-38
    • Barceló, D.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.