1-Hexanol, 2-ethyl-
- Formula: C8H18O
- Molecular weight: 130.2279
- IUPAC Standard InChIKey: YIWUKEYIRIRTPP-UHFFFAOYSA-N
- CAS Registry Number: 104-76-7
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: 2-Ethyl-1-hexanol; 2-Ethylhexan-1-ol; 2-Ethylhexanol; Ethylhexanol; 2-Ethylhexyl alcohol; 2-Ethyl-hexanol-1; Ethylhexyl alcohol; 2-EH; Hexanol, 2-ethyl-; Hexan-1-ol, 2-ethyl; NSC 9300; 2-Ethyl-1-hexyl alcohol; Ethyl-1-hexanol,2-; Octyl alcohol (Related)
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Normal alkane RI, non-polar column, temperature ramp
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 | HP-5 MS | Optima-5 MS | VF-5 MS | VF-5 MS | VF-5 MS |
Column length (m) | 30. | 30. | 60. | 60. | 30. |
Carrier gas | Helium | Helium | Helium | Helium | Helium |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.32 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 45. | 35. | 30. | 30. | 40. |
Tend (C) | 280. | 250. | 260. | 260. | 250. |
Heat rate (K/min) | 15. | 10. | 2. | 2. | 5. |
Initial hold (min) | 3. | 3. | |||
Final hold (min) | 5. | 28. | 28. | 3. | |
I | 1031. | 1029. | 1031. | 1034. | 1033. |
Reference | Wanakhachornkrai and Lertsiri, 9999 | Goeminne, Vandendriessche, et al., 2012 | Leffingwell and Alford, 2011 | Leffingwell and Alford, 2011 | Liu, Lu, et al., 2011 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-5 MS | OV-1 | HP-5 MS | HP-5 MS | HP-5 MS |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | Helium | Helium | Helium | Helium | Helium |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 50. | 70. | 70. | 70. |
Tend (C) | 260. | 250. | 200. | 290. | 290. |
Heat rate (K/min) | 4. | 5. | 3. | 5. | 5. |
Initial hold (min) | 3. | 2. | |||
Final hold (min) | 5. | 2. | 18. | 10. | 10. |
I | 1027. | 1018. | 1035. | 1027. | 1025. |
Reference | Miyazawa, Marumoto, et al., 2011 | Hu, Liang, et al., 2010 | Jerkovic and Marijanovic, 2010 | Radulovic, Blagojevic, et al., 2010 | Radulovic, Dordevic, et al., 2010 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 MS | VF-5 | Mega 5 MS | HP-5 MS | RTX-5 |
Column length (m) | 30. | 30. | 60. | 30. | 30. |
Carrier gas | Helium | Helium | Helium | Helium | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 40. | 50. | 40. |
Tend (C) | 240. | 300. | 240. | 230. | 250. |
Heat rate (K/min) | 3. | 10. | 3. | 4. | 20. |
Initial hold (min) | 2. | 2. | 4. | 5. | |
Final hold (min) | 10. | 10. | |||
I | 1025. | 1035. | 1032. | 1031. | 1060. |
Reference | Silva, Pott, et al., 2010 | Li and Zhao, 2009 | Romeo, Verzera, et al., 2009 | Forero, Quijano, et al., 2008 | Pham, Schilling, 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 | RTX-5 | SPB-5 | SPB-5 | DB-5 |
Column length (m) | 60. | 10. | 60. | 60. | 30. |
Carrier gas | Helium | He | N2 | ||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.18 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 1.0 | 0.2 | 1. | 1. | 1. |
Tstart (C) | 35. | 40. | 40. | 40. | 40. |
Tend (C) | 240. | 275. | 230. | 230. | 230. |
Heat rate (K/min) | 15. | 50. | 3. | 3. | 6. |
Initial hold (min) | 7. | 0.5 | 5. | 5. | 2. |
Final hold (min) | 10. | 0.5 | 5. | 5. | 15. |
I | 1032. | 1034. | 980. | 1030. | 1033. |
Reference | Gogus, Ozel, et al., 2007 | Setkova, Risticevic, et al., 2007 | Vasta, Ratel, et al., 2007 | Vasta, Ratel, et al., 2007 | Fan and Qian, 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | RTX-5Sil | CP Sil 5 CB | HP-5 | 5 % Phenyl methyl siloxane |
Column length (m) | 30. | 30. | 30. | 30. | 0. |
Carrier gas | He | He | He | Helium | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 1. |
Tstart (C) | 60. | 45. | 40. | 40. | 40. |
Tend (C) | 260. | 200. | 220. | 250. | 250. |
Heat rate (K/min) | 4. | 3. | 4. | 5. | 7. |
Initial hold (min) | 4. | 5. | 1. | 2. | 10. |
Final hold (min) | 5. | 5. | |||
I | 1034. | 1032. | 1033. | 1026. | 1028. |
Reference | Morteza-Semnani, Saeedi, et al., 2006 | Holland, Larkov, et al., 2005 | Rohloff and Bones, 2005 | N/A | Ramírez, Estévez, et al., 2004 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5MS | DB-5 | SPB-5 | HP-5 | BP-1 |
Column length (m) | 30. | 60. | 60. | 30. | 25. |
Carrier gas | He | Helium | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.2 |
Phase thickness (μm) | 0.25 | 0.25 | 1.0 | 0.25 | 0.1 |
Tstart (C) | 90. | 35. | 30. | 45. | 40. |
Tend (C) | 200. | 280. | 230. | 280. | 250. |
Heat rate (K/min) | 30. | 5. | 3. | 15. | 8. |
Initial hold (min) | 2. | 2. | 5. | ||
Final hold (min) | 10. | 4. | 11.4 | ||
I | 1043. | 1024. | 1026. | 1031. | 998. |
Reference | Robledo and Arzuffi, 2004 | Dhanda, Pegg, et al., 2003 | Sebastian, Viallon-Fernandez, et al., 2003 | Wanakhachornkrai and Lertsiri, 2003 | Hayes R.A., Richardson B.J., et al., 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-5 | SPB-5 | Methyl Silicone | DB-1 | SE-54 |
Column length (m) | 60. | 60. | 60. | 30. | 36. |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.32 | 0.25 |
Phase thickness (μm) | 1. | 0.25 | 0.25 | 0.5 | 0.25 |
Tstart (C) | 40. | 70. | 40. | 35. | 35. |
Tend (C) | 240. | 240. | 220. | 200. | 240. |
Heat rate (K/min) | 3. | 5. | 5. | 10. | 5. |
Initial hold (min) | 8. | 10. | 1. | ||
Final hold (min) | 20. | ||||
I | 1014. | 1042. | 1016.10 | 1015. | 1038. |
Reference | García, Martín, et al., 2000 | Kim, Kim, et al., 2000 | Baraldi, Rapparini, et al., 1999 | Robacker and Bartelt, 1997 | Huang, Liang, et al., 1996 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SPB-1 | Ultra-2 | DB-5 MS | Ultra-2 | DB-5 |
Column length (m) | 50. | 50. | 30. | 50. | 30. |
Carrier gas | He | He | Helium | He | H2 |
Substrate | |||||
Column diameter (mm) | 0.2 | 0.32 | 0.25 | 0.32 | 0.32 |
Phase thickness (μm) | 0.33 | 0.52 | 0.52 | 1. | |
Tstart (C) | 40. | 40. | 50. | 40. | 40. |
Tend (C) | 200. | 250. | 250. | 250. | 220. |
Heat rate (K/min) | 3. | 4. | 4. | 4. | 3. |
Initial hold (min) | 3. | 3. | 3. | ||
Final hold (min) | 30. | 30. | 30. | ||
I | 1012. | 1034. | 1028. | 1033. | 1030. |
Reference | Wong and Lai, 1996 | King, Matthews, et al., 1995 | Gomez and Ledbetter, 1994 | King, Hamilton, et al., 1993 | Moio, Dekimpe, et al., 1993 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | DB-1 | DB-1 | DB-1 | DB-1 |
Column length (m) | 30. | 60. | 60. | 60. | 60. |
Carrier gas | H2 | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 1. | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 50. | 50. | 50. | 50. |
Tend (C) | 220. | 240. | 240. | 240. | 240. |
Heat rate (K/min) | 3. | 3. | 3. | 3. | 3. |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 1030. | 1012. | 1012. | 1015. | 1018. |
Reference | Moio, Dekimpe, et al., 1993 | Shiota, 1991 | Shiota, 1991 | Shiota, 1991 | Shiota, 1991 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary |
---|---|---|---|
Active phase | DB-1 | OV-101 | DB-1 |
Column length (m) | 50. | 50. | 60. |
Carrier gas | |||
Substrate | |||
Column diameter (mm) | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | |||
Tstart (C) | 0. | 50. | 50. |
Tend (C) | 250. | 225. | 250. |
Heat rate (K/min) | 3. | 4. | 4. |
Initial hold (min) | 0.1 | 0.1 | |
Final hold (min) | 30. | 5. | |
I | 1016. | 1064. | 1013. |
Reference | Habu, Flath, et al., 1985 | Stern, Flath, et al., 1985 | Flath, Mon, et al., 1983 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Wanakhachornkrai and Lertsiri, 9999
Wanakhachornkrai, P.; Lertsiri, S.,
Comparison of determination method for volatile compounds in Thai soy sauce,
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Liu, S.; Lu, S.; Su, Y.; Guo, Y.,
Analysis of volatile compounds in Radix Bupleuri injection by GC-MS-MS,
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Analysis of the volatile fraction of lamb fat tissue: influence of the type of feeding,
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Wanakhachornkrai and Lertsiri, 2003
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Analytical, nutritional, and clinical methods. Comparison of determination method for volatile compounds in Thai soy sauce,
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Microbial populations and volatile compounds in the 'bone taint' spoilage of dry cured ham,
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Chemicals attractive to Mexican fruit fly from Klebsiella pneumoniae and Citrobacter freundii cultures sampled by solid-phase microextraction MICROEXTRACTION,
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Volatile constituents from the fruits of four Syzygium species grown in Malaysia,
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King, Matthews, et al., 1995
King, M.-F.; Matthews, M.A.; Rule, D.C.; Field, R.A.,
Effect of beef packaging method on volatile compounds developed by oven roasting or microwave cooking,
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Gomez and Ledbetter, 1994
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Comparative study of the aromatic profiles of two different plum species: Prunus salicina Lindl and Prunus simonii L.,
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Isolation and identification of volatiles and condensable material in raw beef with supercritical carbon dioxide extraction,
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Neutral volatile compounds in the raw milks from different species,
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Shiota, H.,
Volatile components of pawpaw fruit (Asimina triloba Dunal.),
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Habu, Flath, et al., 1985
Habu, T.; Flath, R.A.; Mon, T.R.; Morton, J.F.,
Volatile components of Rooibos tea (Aspalathus linearis),
J. Agric. Food Chem., 1985, 33, 2, 249-254, https://doi.org/10.1021/jf00062a024
. [all data]
Stern, Flath, et al., 1985
Stern, D.J.; Flath, R.A.; Mon, T.R.; Teranishi, R.; Lundin, R.E.; Benson, M.E.,
Crude oleic acid volatiles,
J. Agric. Food Chem., 1985, 33, 2, 180-184, https://doi.org/10.1021/jf00062a005
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Flath, Mon, et al., 1983
Flath, R.A.; Mon, T.R.; Lorenz, G.; Whitten, C.J.; Mackley, J.W.,
Volatile components of Acacia sp. blossoms,
J. Agric. Food Chem., 1983, 31, 6, 1167-1170, https://doi.org/10.1021/jf00120a008
. [all data]
Notes
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Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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