2-Octenal, (E)-
- Formula: C8H14O
- Molecular weight: 126.1962
- IUPAC Standard InChI: InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h6-8H,2-5H2,1H3/b7-6+
- IUPAC Standard InChIKey: LVBXEMGDVWVTGY-VOTSOKGWSA-N
- CAS Registry Number: 2548-87-0
- 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. - Isotopologues:
- Stereoisomers:
- Other names: (E)-2-Octen-1-al; (E)-2-Octenal; trans-2-Octenal; trans-2-Octen-1-al; 2-(E)-Octenal; (E)-Oct-2-enal; Oct-2(E)-enal; Oct-(E)-2-enal; trans-Oct-2-enal
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz 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 | DB-5MS | DB-5MS | SPB-5 | RH-5MS | DB-5MS |
| Column length (m) | 30. | 30. | 60. | 60. | 30. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 1. | 0.25 | 0.25 |
| Tstart (C) | 40. | 40. | 40. | 40. | 35. |
| Tend (C) | 200. | 200. | 230. | 350. | 225. |
| Heat rate (K/min) | 4. | 4. | 3. | 4. | 10. |
| Initial hold (min) | 1. | 1. | 2. | 2. | 5. |
| Final hold (min) | 10. | 10. | 10. | 10. | 25. |
| I | 1058. | 1052. | 1060. | 1073. | 1058. |
| Reference | Cho, Namgung, et al., 2008 | Cho I.H., Lee S.M., et al., 2007 | Engel and Ratel, 2007 | Hashizume M., Gordon M.H., et al., 2007 | Lozano P.R., Drake M., et al., 2007 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5MS | DB-5 | HP-5MS | DB-5MS | Mega 5MS |
| Column length (m) | 30. | 60. | 30. | 30. | 60. |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 1. | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 35. | 40. | 80. | 40. | 60. |
| Tend (C) | 225. | 260. | 300. | 200. | 240. |
| Heat rate (K/min) | 10. | 4. | 4. | 4. | 3. |
| Initial hold (min) | 5. | 2. | 1. | ||
| Final hold (min) | 25. | 10. | 10. | ||
| I | 1049. | 1063. | 1056.7 | 1052. | 1025. |
| Reference | Lozano P.R., Drake M., et al., 2007 | Methven L., Tsoukka M., et al., 2007 | Zeng, Zhao, et al., 2007 | Cho, Kim, et al., 2006 | Condurso, Verzera, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | SPB-5 | HP-5 | CP Sil 5 CB | CP Sil 5 CB | DB-5MS |
| Column length (m) | 60. | 30. | 25. | 25. | 30. |
| Carrier gas | He | N2 | H2 | He | |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 1. | 0.25 | 0.4 | 0.25 | |
| Tstart (C) | 40. | 60. | 80. | 80. | 40. |
| Tend (C) | 230. | 220. | 270. | 270. | 200. |
| Heat rate (K/min) | 3. | 5. | 10. | 10. | 10. |
| Initial hold (min) | 5. | 10. | 3. | ||
| Final hold (min) | 5. | 20. | |||
| I | 1063. | 1064. | 1034. | 1034. | 1070. |
| Reference | Deport, Ratel, et al., 2006 | Flamini, Tebano, et al., 2006 | Ziegenbein, Hanssen, et al., 2006 | Ziegenbein, Hanssen, et al., 2006, 2 | Carunchia Whetstine, Croissant, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP-Sil 8CB-MS | HP-5MS | HP-5 | DB-5 | ZB-5 |
| Column length (m) | 0. | 30. | 25. | 30. | 0. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.2 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 1. | 0.25 | 0.5 |
| Tstart (C) | 40. | 60. | 40. | 40. | 40. |
| Tend (C) | 280. | 250. | 280. | 200. | 265. |
| Heat rate (K/min) | 4. | 4. | 5. | 10. | 7. |
| Initial hold (min) | 2. | 2. | 5. | ||
| Final hold (min) | 5. | 20. | 5. | 15. | 5. |
| I | 1063. | 1063. | 1062. | 1039. | 1061. |
| Reference | Elmore, Cooper, et al., 2005 | Pino, Mesa, et al., 2005 | Solina, Baumgartner, et al., 2005 | Avsar, Karagul-Yuceer, et al., 2004 | Gocmen, Gurbuz, et al., 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | SPB-5 | HP-5 | HP-5 | SPB-1 | HP-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | He | N2 | N2 | He | N2 |
| 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. | 60. | 35. | 60. |
| Tend (C) | 250. | 220. | 220. | 225. | 220. |
| Heat rate (K/min) | 4. | 5. | 5. | 4. | 5. |
| Initial hold (min) | 2. | 10. | 10. | 5. | 10. |
| Final hold (min) | 20. | 20. | |||
| I | 1066. | 1064. | 1045. | 1031. | 1064. |
| Reference | Píno, Marbot, et al., 2004 | Campeol, Flamini, et al., 2003 | Campeol, Flamini, et al., 2003 | Chisholm, Jell, et al., 2003 | Dural, Bagci, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | DB-5 | DB-5 | DB-5 | BPX-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 50. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.5 | 1. | 0.5 |
| Tstart (C) | 60. | 60. | 40. | 50. | 60. |
| Tend (C) | 240. | 240. | 265. | 200. | 250. |
| Heat rate (K/min) | 3. | 3. | 7. | 2.5 | 4. |
| Initial hold (min) | 5. | ||||
| Final hold (min) | 5. | 20. | |||
| I | 1064. | 1064. | 1056. | 1058.2 | 1076. |
| Reference | Flamini, Cioni, et al., 2003 | Flamini, Luigi Cioni, et al., 2003 | Högnadóttir and Rouseff, 2003 | Xu, van Stee, et al., 2003 | Bredie, Mottram, et al., 2002 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP Sil 8 CB | DB-5 | CP Sil 8 CB | DB-1 | DB-5MS |
| Column length (m) | 60. | 30. | 60. | 60. | 60. |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 1. | 0.25 |
| Tstart (C) | 40. | 35. | 40. | 40. | 40. |
| Tend (C) | 280. | 200. | 250. | 220. | 200. |
| Heat rate (K/min) | 4. | 10. | 4. | 2. | 2. |
| Initial hold (min) | 2. | 5. | 8. | 5. | 5. |
| Final hold (min) | 30. | 10. | 30. | ||
| I | 1063. | 1060. | 1059. | 1032. | 1045. |
| Reference | Elmore, Campo, et al., 2002 | Karagül-Yüceer, Cadwallader, et al., 2002 | Oruna-Concha, Ames, et al., 2002 | Kim, 2001 | Lee, Suriyaphan, et al., 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5MS | HP-5 | CP Sil 8 CB | HP-5 | DB-1 |
| Column length (m) | 60. | 30. | 60. | 30. | 60. |
| Carrier gas | He | He | He | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 1. | |
| Tstart (C) | 40. | 50. | 40. | 50. | 30. |
| Tend (C) | 200. | 200. | 280. | 280. | 200. |
| Heat rate (K/min) | 2. | 4. | 4. | 4. | 5. |
| Initial hold (min) | 5. | 1. | 2. | 5. | |
| Final hold (min) | 30. | 30. | |||
| I | 1045. | 1067. | 1063. | 1056. | 1039. |
| Reference | Lee, Suriyaphan, et al., 2001 | Shalit, Katzir, et al., 2001 | Elmore, Mottram, et al., 2000 | Lazari, Skaltsa, et al., 2000 | Wu, Wang, et al., 2000 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | BPX-5 | BPX-5 | HP-1 | HP-5 | BPX-5 |
| Column length (m) | 50. | 50. | 25. | 30. | 50. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.2 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.33 | 0.25 | 0.50 |
| Tstart (C) | 50. | 50. | 35. | 35. | 40. |
| Tend (C) | 250. | 250. | 250. | 250. | 280. |
| Heat rate (K/min) | 4. | 4. | 4. | 5.3 | 4. |
| Initial hold (min) | 5. | 5. | |||
| Final hold (min) | 5. | 5. | 2. | 2. | |
| I | 1069. | 1070. | 1030. | 1057.7 | 1076. |
| Reference | Mandin, Duckham, et al., 1999 | Mandin, Duckham, et al., 1999 | Siegmund and Pfannhauser, 1999 | Siegmund and Pfannhauser, 1999 | Aaslyng, Elmore, et al., 1998 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | DB-5MS | DB-1 | DB-1 | SE-30 |
| Column length (m) | 30. | 25. | 25. | 50. |
| Carrier gas | He | He | ||
| Substrate | ||||
| Column diameter (mm) | 0.32 | 0.2 | 0.2 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.11 | 0.11 | 0.25 |
| Tstart (C) | 40. | 50. | 50. | 50. |
| Tend (C) | 200. | 250. | 250. | 250. |
| Heat rate (K/min) | 6. | 5. | 5. | 4. |
| Initial hold (min) | 5. | |||
| Final hold (min) | 30. | |||
| I | 1063. | 1035. | 1035. | 1030. |
| Reference | Cha and Cadwallader, 1998 | Warthen, Lee, et al., 1997 | Warthen, Lee, et al., 1997 | Misharina and Golovnya, 1996 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz 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.
Cho, Namgung, et al., 2008
Cho, I.H.; Namgung, H.-J.; Choi, H.-K.; Kim, Y.-S.,
Volatiles and key odorants in the pileus and stipe of pine-mushroom (Tricholoma matsutake Sing.),
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Cho I.H., Lee S.M., et al., 2007
Cho I.H.; Lee S.M.; Kim S.Y.; Choi H.K.; Kim K.O.; Kim Y.S.,
Differentiation of aroma characteristics of pine-mushrooms (Tricholoma matsutake Sing.) of different grades using gas chromatography-olfactometry and sensory analysis,
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Engel and Ratel, 2007
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Correction of the data generated by mass spectrometry analyses of biological tissues: Application to food authentication,
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Instrumental and sensory characterization of heat-induced odorants in aseptically packaged soy milk,
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Characterization of Aroma-Active Compounds in Raw and Cooked Pine-Mushrooms (Tricholoma matsutake Sing.),
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Gocmen, Gurbuz, et al., 2004
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Characterization of the major odorants found in the peel oil of Citrus reticulata Blanco cv. Clementine using gas chromatography-olfactometry,
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Dural, Bagci, et al., 2003
Dural, H.; Bagci, Y.; Ertugrul, K.; Demirelma, H.; Flamini, G.; Cioni, P.L.; Morelli, I.,
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Flamini, Cioni, et al., 2003
Flamini, G.; Cioni, P.L.; Morelli, I.; Ceccarini, L.; Andolfi, L.; Macchia, M.,
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Flamini, Luigi Cioni, et al., 2003
Flamini, G.; Luigi Cioni, P.; Morelli, I.,
Volatiles from leaves, fruits, and virgin oil from Olea europaea Cv. Olivastra Seggianese from Italy,
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Högnadóttir and Rouseff, 2003
Högnadóttir, Á.; Rouseff, R.L.,
Identification of aroma active compounds in organce essence oil using gas chromatography-olfactometry and gas chromatography-mass spectrometry,
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Xu, van Stee, et al., 2003
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Comprehensive two-dimensional gas chromatography (GC×GC) measurements of volatile organic compounds in the atmosphere,
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Bredie, Mottram, et al., 2002
Bredie, W.L.P.; Mottram, D.S.; Guy, R.C.E.,
Effect of temperature and pH on the generation of flavor volatiles in extrusion cooking of wheat flour,
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Elmore, Campo, et al., 2002
Elmore, J.S.; Campo, M.M.; Enser, M.; Mottram, D.S.,
Effect of lipid composition on meat-like model systems containing cysteine, ribose, and polyunsaturated fatty acids,
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Karagül-Yüceer, Cadwallader, et al., 2002
Karagül-Yüceer, Y.; Cadwallader, K.R.; Drake, M.A.,
Volatile flavor components of stored nonfat dry milk,
J. Agric. Food Chem., 2002, 50, 2, 305-312, https://doi.org/10.1021/jf010648a
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Oruna-Concha, Ames, et al., 2002
Oruna-Concha, M.J.; Ames, J.M.; Bakker, J.,
Comparison of the volatile components of eight cultivars of potato after microwave baking,
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Kim, 2001
Kim, J.S.,
Einfluss der Temperatur beim Rösten von Sesam auf Aroma und antioxidative Eigenschaften des Öls, PhD Thesis, Technischen Universität Berlin zur Erlangung des akademischen Grades, Berlin, 2001, 151. [all data]
Lee, Suriyaphan, et al., 2001
Lee, G.-H.; Suriyaphan, O.; Cadwallader, K.R.,
Aroma components of cooked tail meat of American lobster (Homarus americanus),
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Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, References
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