2-Hexenal, (E)-
- Formula: C6H10O
- Molecular weight: 98.1430
- 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, 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 | Supelcowax-10 | Supelcowax-10 | Supelcowax-10 | Supelcowax-10 | CP-Wax 52CB |
Column length (m) | 30. | 30. | 30. | 30. | 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 | 0.25 | 0.25 |
Program | 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 220C(1min) | 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min) | 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min) | 40C(1min) => 10C/min => 120C => 15C/min => 200C (1min) | 45C(5min) => 10C/min => 80C => 2C/min => 240C |
I | 1224. | 1224. | 1225. | 1224. | 1222. |
Reference | Bianchi, Cantoni, et al., 2007 | Bianchi, Careri, et al., 2007 | Bianchi, Careri, et al., 2007 | Bianchi, Careri, et al., 2007 | Romeo, Ziino, et al., 2007 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP-Wax 52CB | DB-Wax | DB-Wax | SOLGel-Wax | SOLGel-Wax |
Column length (m) | 60. | 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 | 0.5 | 0.25 | 0.25 |
Program | 45C(5min) => 10C/min => 80C => 2C/min => 240C | 60C => 5C/min => 200C => 6C/min => 250C(5min) | 40C => 5C/min => 60C(30min) => 5C/min => 240C | 35C(5min) => 3C/min => 150C => 5C/min => 250C(10 min) | 35C(5min) => 3C/min => 150C => 5C/min => 250C (10min) |
I | 1222. | 1223. | 1208. | 1198. | 1198. |
Reference | Condurso, Verzera, et al., 2006 | Guillot, Peytavi, et al., 2006 | Mehinagic, Royer, et al., 2006 | Aubert, Baumann, et al., 2005 | Aubert, Baumann, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SOLGel-Wax | SOLGel-Wax | DB-Wax | CP-Wax 52CB | Stabilwax |
Column length (m) | 30. | 30. | 30. | 50. | 30. |
Carrier gas | He | He | 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 | 0.2 | 1. |
Program | 35C(5min) => 3C/min => 150C => 5C/min => 250C (10min) | 35C(5min) => 3C/min => 150C => 5C/min => 250C (10min) | 40C(5min) => 10C/min => 160C => 15C/min => 230C | 33C(1.5min) => 1.5C/min => 60C(4min) => 2C/min => 100C => 8C/min => 220C(15min) | 40C(2min) => 5C/min => 100C => 4C/min => 230C (10min) |
I | 1198. | 1198. | 1228. | 1201. | 1221. |
Reference | Aubert, Baumann, et al., 2005 | Aubert, Baumann, et al., 2005 | Hallier, Prost, et al., 2005 | Kaack, Christensen, et al., 2005 | Wang, Finn, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Stabilwax | DB-Wax | DB-Wax | Stabilwax | CP-Wax 52CB |
Column length (m) | 30. | 30. | 30. | 30. | 60. |
Carrier gas | He | He | 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 | 1. | 0.25 |
Program | 40C(2min) => 5C/min => 100C => 4C/min => 230C (10min) | 40 (5min) => 4C/min => 140C => 4C/min => 200C (20min) | 40 (5min) => 4C/min => 140C => 4C/min => 200C (20min) | 40C (2min) => 5C/min => 100C => 4C/min => 230C (10min) | 45C(5min) => 10C/min => 80C => 2C/min => 240C |
I | 1248. | 1207. | 1209. | 1244. | 1224. |
Reference | Wang, Finn, et al., 2005 | Zheng, Kim, et al., 2005 | Zheng, Kim, et al., 2005 | Klesk, Qian, et al., 2004 | Verzera, Ziino, et al., 2004 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP-Wax 52CB | DB-Wax | DB-Wax | HP-FFAP | FFAP |
Column length (m) | 60. | 30. | 30. | 30. | 25. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 0.25 | 0.5 | 0.5 | 0.25 | 0.3 |
Program | 40C => 5C/min => 60C => 2.5C/min => 155C | 40C(2min) => 2C/min => 100C => 10C/min => 230C (5min) | 50C => 6C/min => 70C => 4C/min => 150C => 10C/min => 250C | 35C(5min) => 10C/min => 150C => 20C/min => 250C(10 min) | 35C(2min) => 5C/min => 170C => 20C/min => 240C (10min) |
I | 1210. | 1227. | 1221. | 1224. | 1210. |
Reference | Alasalvar, Shahidi, et al., 2003 | Klesk and Qian, 2003 | Pennarun, Prost, et al., 2003 | Carrapiso, Ventanas, et al., 2002 | Fuhrmann and Grosch, 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-Innowax | DB-Wax | DB-Wax | DB-Wax | FFAP |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 0.5 | 0.5 | 0.5 | 0.5 | 0.25 |
Program | 40C(4min) => 10C/min => 70C => 5C/min => 150C => 10C/min => 250C (10min) | 50C => 6C/min => 70C => 4C/min => 150C => 10C/min => 250C | 50C => 5C/min => 180C => 10C/min => 250C | 50C => 5C/min => 180C => 10C/min => 250C | 35C (2min) => 40C/min => 60C => 4C/min => 230C (10min) |
I | 1231. | 1221. | 1238. | 1238. | 1215. |
Reference | Koprivnjak, Conte, et al., 2002 | Pennarun, Prost, et al., 2002 | Sérot, Regost, et al., 2002 | Sérot, Regost, et al., 2001 | Derail, Hofmann, et al., 1999 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|
Active phase | FFAP | HP-Innowax | Supelcowax-10 | Carbowax 20M |
Column length (m) | 30. | 60. | 60. | 150. |
Carrier gas | He | He | He | |
Substrate | ||||
Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.75 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
Program | 35C(2min) => 40C/min => 60C(2min) => 6C/min => 180C => 10C/min => 230C(10 min) | 32C(1.5min) => 3C/min => 40C (10min) => 3C/min => 200C (10min) | 40C => (6C/min) => 80C(6min) => (15C/min) => 200C(10min) | not specified |
I | 1229. | 1232. | 1217. | 1227. |
Reference | Hinterholzer, Lemos, et al., 1998 | Iversen, Jakobsen, et al., 1998 | Cadwallader and Xu, 1994 | Whitfield, Shea, et al., 1981 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, 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.
Bianchi, Cantoni, et al., 2007
Bianchi, F.; Cantoni, C.; Careri, M.; Chiesa, L.; Musci, M.; Pinna, A.,
Characterization of the aromatic profile for the authentication and differentiation of typical Italian dry-sausages,
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Retention indices in the analysis of food aroma volatile compounds in temperature-programmed gas chromatography: Database creation and evaluation of precision and robustness,
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Romeo, Ziino, et al., 2007
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Flavour profile of capers (Capparis spinosa L.) from the Eolian Archipelago by HS-SPME/GC?MS,
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Condurso, Verzera, et al., 2006
Condurso, C.; Verzera, A.; Romeo, V.; Ziino, M.; Trozzi, A.; Ragusa, S.,
The leaf volatile constituents of Isatis tinctoria by solid-phase microextraction and gas chromatography/mass spectrometry,
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Aroma characterization of various apricot varieties using headspace-solid phase microextraction combined with gas chromatography-mass spectrometry and gas chromatography-olfactometry,
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Mehinagic, Royer, et al., 2006
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Characterization of Odor-Active Volatiles in Apples: Influence of Cultivars and Maturity Stage,
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Aubert, Baumann, et al., 2005
Aubert, C.; Baumann, S.; Arguel, H.,
Optimization of the Analysis of Flavor Volatile Compounds by Liquid-Liquid Microextraction (LLME). Application to the Aroma Analysis of Melons, Peaches, Grapes, Strawberries, and Tomatoes,
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Hallier, Prost, et al., 2005
Hallier, A.; Prost, C.; Serot, T.,
Influence in rearing conditions on the volatile compounds of cooked fillets of Silurus glanis (European catfish),
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Kaack, Christensen, et al., 2005
Kaack, K.; Christensen, L.P.; Hughes, M.; Eder, R.,
The relationship between sensory quality and volatile compounds in raw juice processed from elderberries ( Sambucus nigra L.),
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Wang, Finn, et al., 2005
Wang, Y.; Finn, C.; Qian, M.C.,
Impact of Growing Environment on Chickasaw Blackberry ( Rubus L.) Aroma Evaluated by Gas Chromatography Olfactometry Dilution Analysis,
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Zheng, Kim, et al., 2005
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Analysis and characterization of aroma-active compounds of Schizandra chinensis (omija) leaves,
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Klesk, Qian, et al., 2004
Klesk, K.; Qian, M.; Martin, R.R.,
Aroma extract dilution analysis of cv. meeker (Rubus idaeus L.) red raspberries from Oregon and Washington,
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Verzera, Ziino, et al., 2004
Verzera, A.; Ziino, M.; Condurso, C.; Romeo, V.; Zappala, M.,
Solid-phase microextraction and gas chromatography-mass spectrometry for rapid characterisation of semi-hard cheeses,
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Alasalvar, Shahidi, et al., 2003
Alasalvar, C.; Shahidi, F.; Cadwallader, K.R.,
Comparison of natural and roasted Turkish Tombul hazelnut (Corylus avellana L.) volatiles and flavor by DHA/GC/MS and descriptive sensory analysis,
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Klesk and Qian, 2003
Klesk, K.; Qian, M.,
Preliminary aroma comparison of Marion (Rubus spp. hyb) and Evergreen (R. laciniatus L.) blackberries by dynamic headspace/OSME technique,
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Pennarun, A.-L.; Prost, C.; Haure, J.; Demaimay, M.,
Comparison of two microalgal diets. 2. Influence on odorant composition and organoleptic qualities of raw oysters (Crassostrea gigas),
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Carrapiso, Ventanas, et al., 2002
Carrapiso, A.I.; Ventanas, J.; García, C.,
Characterization of the most odor-active compounds of Iberian ham headspace,
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Fuhrmann, E.; Grosch, W.,
Character impact odorants of the apple cultivars Elstar and Cox Orange,
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Koprivnjak, Conte, et al., 2002
Koprivnjak, O.; Conte, L.; Totis, N.,
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Pennarun, A.L.; Prost, C.; Demaimay, M.,
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Hinterholzer, Lemos, et al., 1998
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Cadwallader and Xu, 1994
Cadwallader, K.R.; Xu, Y.,
Analysis of volatile components in fresh grapefruit juice by purge and trap/gas chromatography,
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Whitfield, F.B.; Shea, S.R.; Gillen, K.J.; Shaw, K.J.,
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Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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