Phenol, 2-methoxy-
- Formula: C7H8O2
- Molecular weight: 124.1372
- IUPAC Standard InChIKey: LHGVFZTZFXWLCP-UHFFFAOYSA-N
- CAS Registry Number: 90-05-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: Phenol, o-methoxy-; o-Guaiacol; o-Hydroxyanisole; o-Methoxyphenol; Anastil; Guaiacol; Guaiastil; Guaicolina; Guajol; Guasol; O-Methyl catechol; Pyrocatechol monomethyl ether; Pyroguaiac acid; 1-Hydroxy-2-methoxybenzene; 2-Hydroxyanisole; 2-Methoxyphenol; Guaicol; Guajakol; Methylcatechol; Methylcatachol; Catechol monomethyl ether; o-Guiacol; ortho-Guaiacol; NSC 3815; 2-methoxyphenol (guaiacol); 2-Methoxy phenol (guiacol); guiacol; guaiacol (2-methoxyphenol)
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Normal alkane RI, non-polar column, custom temperature program
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP-Sil 5 CB | SLB-5 MS | SLB-5 MS | Polydimethyl siloxane with 5 % Ph groups | Polydimethyl siloxane with 5 % Ph groups |
| Column length (m) | 50. | 30. | 30. | ||
| Carrier gas | Nitrogen | Helium | Helium | ||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | ||
| Phase thickness (μm) | 1.20 | 0.25 | 0.25 | ||
| Program | 36 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C | not specified | not specified | not specified | not specified |
| I | 1063. | 1087. | 1090. | 1095. | 1102. |
| Reference | Collin, Nizet, et al., 2012 | Mondello, 2012 | Mondello, 2012 | Robinson, Adams, et al., 2012 | Robinson, Adams, et al., 2012 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-5 MS | VF-5 MS | VF-5 MS | CP Sil-5 CB | DB-5 |
| Column length (m) | 30. | 30. | 30. | 50. | 30. |
| Carrier gas | Helium | Helium | Helium | Nitrogen | Hydrogen |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.32 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 1.20 | 0.50 |
| Program | 40 0C (1 min) 3 0C/min -> 150 0C (15 min) 5 0C/min -> 250 0C (5 min) | not specified | not specified | 36 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C | 40 0C (5 min) 4 0C/min -> 100 0C 6 0C/min -> 220 0C (20 min) |
| I | 1063. | 1093. | 1090. | 1063. | 1086. |
| Reference | Rodrigues, Hanson, et al., 2012 | Souza, Re-Poppi, et al., 2012 | Liu, Lu, et al., 2011 | Bailly and Collin, 2010 | San-Juan, Petka, et al., 2010 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP-Sil 5 CB | ZB-1 MS | SE-54 | DB-5 | ZB-5 |
| Column length (m) | 50. | 30. | 30. | 30. | 30. |
| Carrier gas | Nitrogen | Helium | Helium | Hydrogen | Helium |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.32 | 0.32 | 0.25 |
| Phase thickness (μm) | 1.20 | 0.25 | 0.25 | 0.50 | 0.25 |
| Program | 36 0C 20 0C/min -> 85 0C 1 0C -> 145 0C 3 0C/min -> 250 0C | 50 0C 3 0C/min -> 150 0C (10 min) 10 0C/min -> 250 0C | 35 0C (2 min) 10 0C/min -> 50 0C (2 min) 6 0C/min -> 250 0C | 40 0C 2 0C/min -> 12 0C/min -> 105 0C 6 0C/min -> 220 0C (20 min) | 45 0C 3 0C/min -> 230 0C (10 min) 10 0C/min -> 270 0C (21 min) |
| I | 1063. | 1090. | 1089. | 1089. | 1089. |
| Reference | Bailly, Jerkovic, et al., 2009 | Bajpai, Al-Reza, et al., 2009 | Christlbauer and Schieberle, 2009 | Prat, Trias, et al., 2009 | de Simon, Estruelas, et al., 2009 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP-Sil 5 Cb | SE-54 | SLB-5MS | HP-5 | HP-5 |
| Column length (m) | 50. | 10. | 30. | 30. | |
| Carrier gas | Nitrogen | Helium | Helium | ||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.18 | 0.25 | 0.25 | |
| Phase thickness (μm) | 1.20 | 0.18 | 0.25 | 0.25 | |
| Program | 40 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C (30 min) | not specified | not specified | 40 0C (2 min) 5 0C/min -> 80 0C 7 oC/min -> 160 0C 9 0C/min -> 200 0C 20 0C/min -> 280 0C (10 min) | not specified |
| I | 1064. | 1087. | 1104. | 1090. | 1088. |
| Reference | Collin, Nizet, et al., 2008 | Frauendorfer and Schieberle, 2008 | Risticevic, Carasek, et al., 2008 | Zhao, Li, et al., 2008 | Zhao, Li, et al., 2008 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 MS | DB-5 MS | DB-5 MS | DB-5 | SE-54 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | Helium | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Program | 50 0C (2.8 min) 5.5 0C/min -> 140 0C (1 min) 4.5 oC/min -> 220 0C -> 225 0C (2 min) 3.4 0C/min -> 265 0C (5 min) | 50 0C (2.8 min) 5.5 0C/min -> 140 0C (1 min) 4.5 oC/min -> 220 0C -> 225 0C (2 min) 3.4 0C/min -> 265 0C (5 min) | 45 0C (0.75 min) 10 0C/min -> 200 0C 30 0C/min -> 245 0C (1.25 min) | 40C(1min) => 7C/min => 110C => 5C/min => 180C => 10C/min => 240C(10min) | 35C(2min) => 40C/min => 60C(2min) => 6C/min => 180C => 10C/min => 230C(10min) |
| I | 1056. | 1082. | 1094. | 1095. | 1089. |
| Reference | Zhu, Li, et al., 2008 | Zhu, Li, et al., 2008 | Cajka, Hajslova, et al., 2007 | Greger and Schieberle, 2007 | Lasekan, Buettner, et al., 2007 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | Polydimethyl siloxane | CP-Sil 5 CB | CP Sil 5 CB | HP-5 | HP-5MS |
| Column length (m) | 50. | 50. | 26. | 30. | |
| Carrier gas | Helium | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.2 | 0.25 | |
| Phase thickness (μm) | 1.20 | 1.2 | 0.25 | 0.25 | |
| Program | not specified | 36 0C 20 0C/min -> 85 0C 1 0C/min -> 1345 0C 3 0C/min -> 250 0C | 36C => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C | 60C(5min) => 6C/min => 200C => 15C/min => 250C(5min) | 40C(1min) => 8C/min => 160C => 12C/min => 300C(5min) |
| I | 1057. | 1063. | 1063. | 1086. | 1089. |
| Reference | RAyne and Eggers, 2007 | Bailly, Jerkovic, et al., 2006 | Bailly, Jerkovic, et al., 2006, 2 | Baroni, Nores, et al., 2006 | Li, Deng, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP-Sil5 CB MS | Polydimethyl siloxane with 5 % Ph groups | DB-5 | SE-54 | MFE-73 |
| Column length (m) | 50. | 30. | 30. | ||
| Carrier gas | He | He | |||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.32 | ||
| Phase thickness (μm) | 1.2 | 0.25 | 0.25 | ||
| Program | 36C(2min) => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C(30min) | not specified | 40 0C (2 min) 6 K/min -> 190 0C 12 K/min -> 240 0C | 40C(2min) => 40C/min => 50C(2min) => 6C/min => 180C => 15C/min => 230C (10min) | not specified |
| I | 1064. | 1087. | 1088. | 1089. | 1086. |
| Reference | Iraqi, Vermeulen, et al., 2005 | Pino, Marbot, et al., 2005 | Steinhaus and Schieberle, 2005 | Buettner, 2004 | Escudero, Gogorza, et al., 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | SE-30 | HP-5MS | DB-5 | CP Sil 5 CB |
| Column length (m) | 30. | 30. | 30. | 50. | |
| Carrier gas | He | He | |||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.53 | 0.32 | |
| Phase thickness (μm) | 0.25 | 0.25 | 1.5 | 1.2 | |
| Program | 40C(1min) => 9C/min => 130C => 2C/min => 230C | not specified | 40C(5min) => 2C/min => 120C => 10C/min => 210C (30min) | -5C(1min) => 4C/min => 50C => 6C/min => 120C => 8C/min => 250C(2min) | 36C => 20C/min => 85C => 1C/min => 145C=3C/min => 250C(30min) |
| I | 1074. | 1071. | 1088. | 1096. | 1063. |
| Reference | Hamm, Bleton, et al., 2004 | Vinogradov, 2004 | Martí, Mestres, et al., 2003 | Bücking and Steinhart, 2002 | Counet, Callemien, et al., 2002 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | MFE-73 | Methyl phenyl siloxane (not specified) | HP-5MS | MFE-73 | MFE-73 |
| Column length (m) | 30. | 30. | 30. | ||
| Carrier gas | H2 | He | H2 | H2 | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | ||
| Phase thickness (μm) | 0.25 | 0.1 | 0.1 | ||
| Program | not specified | not specified | 40C (10min) => 3C/min => 120C => 10C/min => 250C (5min) | 40C(5min) => 2C/min => 120C => 10C/min => 210C(30min) | 40 C (5min) => 2C/min => 120C => 10 C/min => 210 C (30min) |
| I | 1086. | 1096. | 1089. | 1086. | 1086. |
| Reference | Ferreira, Ortín, et al., 2002 | Poligne, Collignan, et al., 2002 | Ansorena, Gimeno, et al., 2001 | Aznar, López, et al., 2001 | Ferreira, Aznar, et al., 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP Sil 5 CB | HP-5 | CP Sil 5 CB | OV-101 | DB-5 |
| Column length (m) | 50. | 30. | 50. | 30. | |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.32 | 0.32 | |
| Phase thickness (μm) | 1.2 | 0.25 | 1.2 | 0.25 | |
| Program | 36C => 20C/min => 120C(20min) => 2C/min => 250C(30min) | 40C (10min) => 3C/min => 120C => 10C/min => 250C (5min) | 30C => 55C/min => 85C => 1C/min => 145C => 3C/min => 250C | not specified | 35C(1min) => 40C/min => 60C (1min) => 6C/min => 230C |
| I | 1066. | 1087. | 1071. | 1058. | 1095. |
| Reference | Lermusieau, Bulens, et al., 2001 | Ansorena, Astiasarán, et al., 2000 | Guyot, Bouseta, et al., 1998 | Licker, Acree, et al., 1998 | Matsui, Guth, et al., 1998 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | SE-54 | DB-5 | SE-54 | DB-5 | DB-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | He | He | |||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | |||
| Program | 35 0C (2 min) 40 0C/min -> 50 0C (1 min) 6 0C/min -> 230 0C | 35C (1min) => 40C/min => 60C (1min) => 6C/min => 250C (10min) | 35C => 40C/min => 60C (1min) => 6C/min => 250C | not specified | 35C => 40C/min => 50C(2min) => 4C/min => 240C |
| I | 1090. | 1090. | 1099. | 1092. | 1088. |
| Reference | Reiners and Grosch, 1998 | Guth, 1997 | Lizárraga-Guerra, Guth, et al., 1997 | Schieberle, 1996 | Schieberle and Grosch, 1994 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Other |
|---|---|---|---|---|---|
| Active phase | SE-54 | SE-30 | OV-101 | OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc. | Methyl Silicone |
| Column length (m) | 50. | ||||
| Carrier gas | Hydrogen | ||||
| Substrate | |||||
| Column diameter (mm) | 0.32 | ||||
| Phase thickness (μm) | |||||
| Program | not specified | not specified | not specified | not specified | not specified |
| I | 1093. | 1095. | 1071. | 1077. | 1092. |
| Reference | Blank, Sen, et al., 1992 | Peterson, 1992 | Shibamoto, 1987 | Waggott and Davies, 1984 | Ardrey and Moffat, 1981 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
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Steinhaus and Schieberle, 2005
Steinhaus, M.; Schieberle, P.,
Characterization of odorants causing an atypical aroma in white pepper powder (Piper nigrum L.) based on quantitative measurements and orthonasal breakthrough thresholds,
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Buettner, 2004
Buettner, A.,
Investigation of potent odorants and afterodor development in two chardonnay wines using the Buccal Odor Screening System (BOSS),
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Escudero, A.; Gogorza, B.; Melús, M.A.; Ortín, N.; Cacho, J.; Ferreira, V.,
Characterization of the aroma of a wine from Maccabeo. Key role played by compounds with low odor activity values,
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Hamm, Bleton, et al., 2004
Hamm, S.; Bleton, J.; Tchapla, A.,
Headspace solid phase microextraction for screening for the presence of resins in Egyptian archaeological samples,
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Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]
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Martí, M.P.; Mestres, M.; Sala, C.; Busto, O.; Guasch, J.,
Solid-phase microextraction and gas chromatography olfactometry analysis of successively diluted samples. A new approach of the aroma extract dilution analysis applied to the characterization of wine aroma,
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Bücking and Steinhart, 2002
Bücking, M.; Steinhart, H.,
Headspace GC and sensory analysis characterization of the influence of different milk additives on the flavor release of coffee beverages,
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Counet, Callemien, et al., 2002
Counet, C.; Callemien, D.; Ouwerx, C.; Collin, S.,
Use of gas chromatography-olfactometry to identify key odorant compounds in dark chocolate. Comparison of samples before and after conching,
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Ferreira, Ortín, et al., 2002
Ferreira, V.; Ortín, N.; Escudero, A.; López, R.; Cacho, J.,
Chemical characterization of the aroma of grenache Rosé wines: aroma extract dilution analysis, quantitative determination, and sensory reconstitution studies,
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Poligne, Collignan, et al., 2002
Poligne, I.; Collignan, A.; Trystram, G.,
Effects of salting, drying, cooking, and smoking operations on volatile compound formation and collor patterns in pork,
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Ansorena, Gimeno, et al., 2001
Ansorena, D.; Gimeno, O.; Astiasarán, I.; Bello, J.,
Analysis of volatile compounds by GC-MS of a dry fermented sausage: chorizo de Pamplona,
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Aznar, López, et al., 2001
Aznar, M.; López, R.; Cacho, J.F.; Ferreira, V.,
Identification and quantification of impact odorants of aged red wines from Rioja. GC-olfactometry, quantitative GC-MS, and odor evaluation of HPLC fractions,
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Ferreira, Aznar, et al., 2001
Ferreira, V.; Aznar, M.; López, R.; Cacho, J.,
Quantitative gas chromatography-olfactometry carried out at different dilutions of an extract. Differences in the odor profiles of four high-quality spanish aged red wines,
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Lermusieau, Bulens, et al., 2001
Lermusieau, G.; Bulens, M.; Collin, S.,
Use of GC-olfactometry to identify the hop aromatic compounds in beer,
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Ansorena, Astiasarán, et al., 2000
Ansorena, D.; Astiasarán, I.; Bello, J.,
Influence of the simultaneous addition of the protease flavourzyme and the lipase novozyme 677BG on dry fermented sausage compounds extracted by SDE and analyzed by GC-MS,
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Guyot, C.; Bouseta, A.; Scheirman, V.; Collin, S.,
Floral origin markers of chestnut and lime tree honeys,
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Licker, Acree, et al., 1998
Licker, J.L.; Acree, T.E.; Henick-Kling, T.,
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Matsui, Guth, et al., 1998
Matsui, T.; Guth, H.; Grosch, W.,
A comparative study of potent odorants in peanut, hazelnut, and pumpkin seed oils on the basis of aroma extract dilution analysis (AEDA) and gas chromatography-olfactometry of headspace samples (GCOH),
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Reiners, J.; Grosch, W.,
Odorants of virgin olive oils with different flavor profiles,
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Guth, H.,
Identification of character impact odorants of different white wine varieties,
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Lizárraga-Guerra, R.; Guth, H.; López, M.G.,
Identification of the most potent odorants in huitlacoche (Ustilago maydis) and austern pilzen (Pleurotus sp.) by aroma extract dilution analysis and static head-space samples,
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Schieberle, 1996
Schieberle, P.,
Odour-active compounds in moderately roasted sesame,
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Schieberle and Grosch, 1994
Schieberle, P.; Grosch, W.,
Potent odorants of rye bread crust - differences from the crumb and from wheat bread crust,
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Blank, Sen, et al., 1992
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Potent odorants of the roasted powder and brew of Arabica coffee,
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Peterson, 1992
Peterson, K.L.,
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Shibamoto, 1987
Shibamoto, T.,
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Waggott and Davies, 1984
Waggott, A.; Davies, I.W.,
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Ardrey and Moffat, 1981
Ardrey, R.E.; Moffat, A.C.,
Gas-liquid chromatographic retention indices of 1318 substances of toxicological interest on SE-30 or OV-1 stationary phase,
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. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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