2-Hexenal, (E)-
- Formula: C6H10O
- Molecular weight: 98.1430
- IUPAC Standard InChI: InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+
- IUPAC Standard InChIKey: MBDOYVRWFFCFHM-SNAWJCMRSA-N
- CAS Registry Number: 6728-26-3
- 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. - Species with the same structure:
- Isotopologues:
- Stereoisomers:
- Other names: (E)-2-Hexenal; n-Hex-trans-2-enal; trans-Hex-2-enal; trans-2-Hexen-1-al; trans-2-Hexenal; Leaf aldehyde; 2-trans-Hexenal; (2E)-2-Hexenal; 2-(E)-Hexenal; (E)-2-Hexanal; (E)-2-Hexen-1-al; (E)-Hex-2-en-1-al; (E)-Hex-2-enal; Hex-2(E)-enal; Hex-trans-2-enal; t-2-Hexenal; 2-Hexenal, (2E)-
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz RI, 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-Wax Etr | HP-Innowax | DB-Wax Etr | DB-Wax | HP-Wax |
| Column length (m) | 30. | 60. | 30. | 30. | 30. |
| Carrier gas | 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 | 0.25 | 0.25 |
| Tstart (C) | 40. | 50. | 40. | 50. | 60. |
| Tend (C) | 250. | 220. | 250. | 230. | 220. |
| Heat rate (K/min) | 5. | 4. | 5. | 10. | 5. |
| Initial hold (min) | 3. | 4. | 3. | 5. | 10. |
| Final hold (min) | 15. | 10. | 15. | 25. | |
| I | 1220. | 1220. | 1220. | 1215. | 1222. |
| Reference | Aubert and Chanforan, 2007 | Quijano, Linares, et al., 2007 | Aubert C. and Pitrat M., 2006 | Fernandez-Segovia, Escriche, et al., 2006 | Flamini, Tebano, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | Stabilwax | Supelcowax-10 | DB-Wax | Supelcowax-10 |
| Column length (m) | 30. | 60. | 60. | 30. | 30. |
| Carrier gas | He | He | He | He | 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) | 50. | 40. | 40. | 40. | 60. |
| Tend (C) | 220. | 240. | 280. | 250. | 240. |
| Heat rate (K/min) | 4. | 3. | 4. | 3. | 3. |
| Initial hold (min) | 4. | 5. | 2. | 5. | |
| Final hold (min) | 20. | 10. | 20. | 10. | |
| I | 1205. | 1212. | 1231. | 1200. | 1234. |
| Reference | Osorio, Alarcon, et al., 2006 | Cros, Lignot, et al., 2005 | Elmore, Nisyrios, et al., 2005 | Gancel, Ollitrault, et al., 2005 | Riu-Aumatell, Lopez-Tamames, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-Wax | HP-Wax | DB-Wax Etr | DB-Wax | DB-Wax |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | N2 | N2 | He | He | 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. | 45. | 45. |
| Tend (C) | 240. | 220. | 245. | 240. | 240. |
| Heat rate (K/min) | 3. | 5. | 3. | 6. | 6. |
| Initial hold (min) | 10. | 3. | 10. | 10. | |
| Final hold (min) | 20. | 30. | 30. | ||
| I | 1220. | 1220. | 1218. | 1230. | 1230. |
| Reference | Flamini, Cioni, et al., 2004 | Flamini, Luigi Cioni, et al., 2004 | Ménager, Jost, et al., 2004 | Nielsen, Larsen, et al., 2004 | Nielsen, Larsen, et al., 2004, 2 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | DB-Wax | DB-Wax | DB-Wax |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | He | He | He | He | 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) | 45. | 45. | 40. | 40. | 40. |
| Tend (C) | 240. | 240. | 200. | 200. | 200. |
| Heat rate (K/min) | 6. | 3. | 4. | 4. | 4. |
| Initial hold (min) | 10. | 10. | 5. | 5. | 5. |
| Final hold (min) | 30. | 30. | 20. | 20. | 20. |
| I | 1230. | 1201. | 1200. | 1204. | 1206. |
| Reference | Nielsen, Larsen, et al., 2004, 3 | Nielsen and Poll, 2004 | Yu, Kim, et al., 2004 | Yu, Kim, et al., 2004 | Yu, Kim, et al., 2004, 2 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | DB-Wax | DB-Wax | DB-Wax |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.5 | 0.5 |
| Tstart (C) | 40. | 40. | 40. | 40. | 40. |
| Tend (C) | 200. | 200. | 200. | 245. | 245. |
| Heat rate (K/min) | 4. | 4. | 4. | 2. | 2. |
| Initial hold (min) | 5. | 5. | 5. | 3. | 3. |
| Final hold (min) | 20. | 20. | 20. | 20. | 20. |
| I | 1202. | 1204. | 1207. | 1220. | 1220. |
| Reference | Yu, Kim, et al., 2004, 2 | Zheng, Kim, et al., 2004 | Zheng, Kim, et al., 2004 | Aubert, Günata, et al., 2003 | Aubert, Günata, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-Wax | HP-Wax | Stabilwax | HP-Wax | DB-Wax |
| Column length (m) | 30. | 30. | 60. | 30. | 60. |
| Carrier gas | N2 | N2 | He | N2 | H2 |
| 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 |
| Tstart (C) | 60. | 60. | 40. | 60. | 40. |
| Tend (C) | 220. | 220. | 240. | 220. | 245. |
| Heat rate (K/min) | 5. | 5. | 3. | 5. | 1.5 |
| Initial hold (min) | 10. | 10. | 5. | 10. | |
| Final hold (min) | 10. | 20. | |||
| I | 1220. | 1220. | 1212. | 1220. | 1200. |
| Reference | Campeol, Flamini, et al., 2003 | Campeol, Flamini, et al., 2003 | Cros, Vandanjon, et al., 2003 | Emilio Tomei, Manganelli, et al., 2003 | Gancel, Ollitrault, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | AT-Wax | ZB-Wax | Supelcowax-10 | AT-Wax |
| Column length (m) | 30. | 60. | 60. | 60. | 60. |
| Carrier gas | He | He | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 40. | 65. | 40. | 35. | 65. |
| Tend (C) | 240. | 250. | 220. | 195. | 250. |
| Heat rate (K/min) | 6. | 2. | 3. | 2. | 2. |
| Initial hold (min) | 10. | 10. | 5. | 10. | |
| Final hold (min) | 30. | 60. | 90. | 60. | |
| I | 1230. | 1205. | 1222. | 1221. | 1206. |
| Reference | Nielsen, Larsen, et al., 2003 | Pino, Almora, et al., 2003 | Brunton, Cronin, et al., 2002 | Chung, Yung, et al., 2002 | Pino, Marbot, et al., 2002 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | Supelcowax-10 | AT-Wax | AT-Wax | CP-Wax 52CB | DB-Wax |
| Column length (m) | 60. | 60. | 60. | 50. | 30. |
| Carrier gas | He | He | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.2 | 0.25 |
| Tstart (C) | 35. | 65. | 65. | 30. | 40. |
| Tend (C) | 195. | 250. | 250. | 220. | 200. |
| Heat rate (K/min) | 2. | 2. | 2. | 2. | 2. |
| Initial hold (min) | 5. | 10. | 10. | 1.3 | 5. |
| Final hold (min) | 90. | 60. | 60. | 20. | |
| I | 1221. | 1206. | 1206. | 1201. | 1209. |
| Reference | Chung, Yung, et al., 2001 | Pino and Marbot, 2001 | Pino, Marbot, et al., 2001 | Jensen, Christensen, et al., 2000 | Kim, Thuy, et al., 2000 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | Supelcowax-10 | DB-Wax | DB-Wax | HP-Wax |
| Column length (m) | 30. | 60. | 60. | 30. | 50. |
| Carrier gas | He | He | |||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.32 | 0.2 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.5 | 0.4 |
| Tstart (C) | 40. | 35. | 40. | 40. | 30. |
| Tend (C) | 230. | 195. | 200. | 245. | 220. |
| Heat rate (K/min) | 3. | 2. | 3. | 3. | 5. |
| Initial hold (min) | 4. | 5. | 5. | 3. | 1. |
| Final hold (min) | 90. | 60. | 20. | 30. | |
| I | 1201. | 1223. | 1214. | 1209. | 1231. |
| Reference | Ruther, 2000 | Chung, 1999 | Cha, Kim, et al., 1998 | Ollé, Baumes, et al., 1998 | Christensen, Jakobsen, et al., 1997 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | DB-Wax | DB-Wax | Supelcowax-10 |
| Column length (m) | 60. | 60. | 30. | 60. | 60. |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
| Tstart (C) | 50. | 50. | 40. | 40. | 40. |
| Tend (C) | 230. | 230. | 200. | 200. | 195. |
| Heat rate (K/min) | 2. | 2. | 2. | 3. | 2. |
| Initial hold (min) | 5. | 5. | 5. | ||
| Final hold (min) | 60. | 40. | |||
| I | 1209. | 1196. | 1207. | 1219. | 1216. |
| Reference | Shimoda, Shiratsuchi, et al., 1996 | Shimoda, Shigematsu, et al., 1995 | Iwaoka, Hagi, et al., 1994 | Sumitani, Suekane, et al., 1994 | Chung and Cadwallader, 1993 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-20M | HP-FFAP | Carbowax 20M | Carbowax 20M | Carbowax 20M |
| Column length (m) | 50. | 50. | 25. | 25. | 25. |
| Carrier gas | He | He | |||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.31 | 0.31 | 0.31 |
| Phase thickness (μm) | 0.3 | ||||
| Tstart (C) | 60. | 60. | 50. | 50. | 50. |
| Tend (C) | 190. | 210. | 200. | 200. | 200. |
| Heat rate (K/min) | 3. | 3. | 2. | 2. | 2. |
| Initial hold (min) | |||||
| Final hold (min) | |||||
| I | 1209. | 1250. | 1210. | 1207. | 1210. |
| Reference | Chung, Eiserich, et al., 1993 | Chung, Eiserich, et al., 1993 | Suárez and Duque, 1992 | Suárez and Duque, 1991 | Suárez and Duque, 1991 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | DB-Wax | Carbowax 20M |
| Column length (m) | 30. | 30. | 30. | 50. |
| Carrier gas | He | He | He | H2 |
| Substrate | ||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.2 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
| Tstart (C) | 40. | 50. | 50. | 50. |
| Tend (C) | 220. | 250. | 250. | 200. |
| Heat rate (K/min) | 5. | 4. | 4. | 2. |
| Initial hold (min) | 3. | 3. | 3. | |
| Final hold (min) | 55. | |||
| I | 1212. | 1212. | 1217. | 1196. |
| Reference | Frohlich and Schreier, 1990 | Fröhlich, Duque, et al., 1989 | Fröhlich, Duque, et al., 1989 | Wu and Liou, 1986 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, 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.
Aubert and Chanforan, 2007
Aubert, C.; Chanforan, C.,
Postharvest Changes in Physicochemical Properties and Volatile Constituents of Apricot (Prunus armeniaca L.). Characterization of 28 Cultivars,
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Quijano, Linares, et al., 2007
Quijano, C.E.; Linares, D.; Pino, J.A.,
Changes in volatile compounds of fermented cereza agria [Phyllanthus acidus (L.) Skeels] fruit,
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Aubert C. and Pitrat M., 2006
Aubert C.; Pitrat M.,
Volatile compounds in the skin and pulp of Queen Anne's pocket melon,
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Fernandez-Segovia, Escriche, et al., 2006
Fernandez-Segovia, I.; Escriche, I.; Gomez-Sintes, M.; Fuentes, A.; Serra, J.A.,
In?uence of di?erent preservation treatments on the volatile fraction of desalted cod,
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Flamini, Tebano, et al., 2006
Flamini, G.; Tebano, M.; Cioni, P.L.; Bagci, Y.; Dural, H.; Ertugrul, K.; Uysal, T.; Savran, A.,
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Osorio, Alarcon, et al., 2006
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Characterization of Odor-Active Volatiles in Champa ( Campomanesia lineatifolia R. P.),
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Cros, Lignot, et al., 2005
Cros, S.; Lignot, B.; Bourseau, P.; Jaouen, P.; Prost, C.,
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Elmore, Nisyrios, et al., 2005
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Analysis of the headspace aroma compounds of walnuts (Juglans regia L.),
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Gancel, Ollitrault, et al., 2005
Gancel, A.-L.; Ollitrault, P.; Froelicher, Y.; Tomi, F.; Jacquemond, C.; Luro, F.; Brillouet, J.-M.,
Leaf volatile compounds of six citrus somatic allotetraploid hybrids originating from various combinations of lime, lemon, citron, sweet orange, and grapefruit,
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Riu-Aumatell, Lopez-Tamames, et al., 2005
Riu-Aumatell, M.; Lopez-Tamames, E.; Buxaderas, S.,
Assessment of the Volatile Composition of Juices of Apricot, Peach, and Pear According to Two Pectolytic Treatments,
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Flamini, Cioni, et al., 2004
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Flamini, Luigi Cioni, et al., 2004
Flamini, G.; Luigi Cioni, P.; Morelli, I.,
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Ménager, Jost, et al., 2004
Ménager, I.; Jost, M.; Aubert, C.,
Changes in physicochemical characteristics and volatile constituents of strawberry (Cv. Cigaline) during maturation,
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Nielsen, Larsen, et al., 2004
Nielsen, G.S.; Larsen, L.M.; Poll, L.,
Formation of aroma compounds during long-term frozen storage of unblanched leek (Allium ampeloprasum Var. Bulga) as affected by packaging atmosphere and slice thickness,
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Nielsen, Larsen, et al., 2004, 2
Nielsen, G.S.; Larsen, L.M.; Poll, L.,
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Nielsen, Larsen, et al., 2004, 3
Nielsen, G.S.; Larsen, L.M.; Poll, L.,
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Nielsen and Poll, 2004
Nielsen, G.S.; Poll, L.,
Determination of odor active aroma compounds in freshly cut leek (Allium ampeloprasum Var. Bulga) and in long-term stored frozen unblanched and blanched leek slices by gas chromatography olfactometry analysis,
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Yu, Kim, et al., 2004
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Aroma-active compounds of Pinus densiflora (red pine) needles,
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Yu, Kim, et al., 2004, 2
Yu, E.J.; Kim, T.H.; Kim, K.H.; Lee, H.J.,
Characterization of aroma-active compounds of Abies nephrolepis (Khingan fir) needles using aroma extract dilution analysis,
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Zheng, Kim, et al., 2004
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Aubert, Günata, et al., 2003
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Changes in physicochemical characteristics and volatile constituents of yellow- and white-fleshed nectarines during maturation and artificial ripening,
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Campeol, Flamini, et al., 2003
Campeol, E.; Flamini, G.; Cioni, P.L.; Morelli, I.; Cremonini, R.; Ceccarini, L.,
Volatile fractions from three cultivars of Olea eruopaea L. collected in two different seasons,
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Cros, Vandanjon, et al., 2003
Cros, S.; Vandanjon, L.; Jaouen, P.; Bourseau, P.,
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Emilio Tomei, Manganelli, et al., 2003
Emilio Tomei, P.; Manganelli, R.E.U.; Flamini, G.; Cioni, P.L.; Morelli, I.,
Composition of the essential oil of Mentha microphylla from the Gennargentu Mountains (Sardinia, Italy),
J. Agric. Food Chem., 2003, 51, 12, 3614-3617, https://doi.org/10.1021/jf026091w
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Gancel, Ollitrault, et al., 2003
Gancel, A.-L.; Ollitrault, P.; Froelicher, Y.; Tomi, F.; Jacquemond, C.; Luro, F.; Brillouet, J.-M.,
Leaf volatile compounds of seven citrus somatic tetraploid hybrids sharing willow leaf mandarin (Citrus deliciosa Ten.) as their common parent,
J. Agric. Food Chem., 2003, 51, 20, 6006-6013, https://doi.org/10.1021/jf0345090
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Nielsen, G.S.; Larsen, L.M.; Poll, L.,
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Volatile components of papaya (Carica papaya L., maradol variety) fruit,
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Characterization of volatile in Cosa Rican Guava [Psidium friedrichsthalianum (Berg) Niedenzu] fruit,
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Chung, Yung, et al., 2001
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Pino and Marbot, 2001
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Volatile flavor constituents of acerola (Malpighia emarginata DC.) fruit,
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Pino, Marbot, et al., 2001
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Jensen, Christensen, et al., 2000
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Retention index database for identification of general green leaf volatiles in plants coupled capillary gas chromatography-mass spectrometry,
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Volatiles emitted from flowers of γ-radiated and nonradiated Jasminum polyanthum Franch. in Situ,
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Volatile components in blue crab (Callinectes sapidus) meat and processing by-product,
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Change in volatile compounds during lulo (Solanum vestissimum D.) fruit maturation,
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Suárez and Duque, 1991
Suárez, M.; Duque, C.,
Volatile constituents of lulo (Salanum vestissimum D.) fruit,
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Volatile Constituents of Loquat (Eriobotrya japonica Lindl.) Fruit,
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Volatile constituents of curuba (Passiflora mollissima) fruit,
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Wu and Liou, 1986
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Effect of tissue disruption of volatile constituents of bell peppers,
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. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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