Butanoic acid, 3-hexenyl ester, (E)-
- Formula: C10H18O2
- Molecular weight: 170.2487
- IUPAC Standard InChI: InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+
- IUPAC Standard InChIKey: ZCHOPXVYTWUHDS-AATRIKPKSA-N
- CAS Registry Number: 53398-84-8
- Chemical structure:
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- Stereoisomers:
- Other names: trans-3-Hexenyl butyrate; 3-Hexenyl butyrate (E); (3E)-3-Hexenyl butyrate; Butanoic acid, (E)-3-hexenyl ester; (E)-3-Hexen-1-ol, butanoate; (E)-3-Hexenyl butanoate; (E)-3-Hexenyl butyrate; E-Hex-3-en-1-yl butyrate; (E)-Hex-3-enyl n-butyrate; (E)-hex-3-enyl butyrate
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Normal alkane RI, non-polar column, temperature ramp
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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 |
|---|---|---|
| Active phase | HP-5 MS | RTX-1 |
| Column length (m) | 30. | 30. |
| Carrier gas | Helium | N2 |
| Substrate | ||
| Column diameter (mm) | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 |
| Tstart (C) | 50. | 60. |
| Tend (C) | 250. | 300. |
| Heat rate (K/min) | 10. | 4. |
| Initial hold (min) | 2. | |
| Final hold (min) | 5. | |
| I | 1185. | 1166. |
| Reference | Yasuda, Shigehisa, et al., 2008 | Lis, Boczek, et al., 2004 |
| Comment | 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.
Yasuda, Shigehisa, et al., 2008
Yasuda, T.; Shigehisa, S.; Yuasa, K.; Okutani-Akamatsu, Y.; Teramoto, N.; Watanabe, T.; Mochizuki, F.,
Sex attactant pheromone of the sorghum plant bug Stenotus rubrovittatus (Natsumura) (Heteroptera: Miridae),
Appl. Entomol. Zool., 2008, 43, 2, 219-226, https://doi.org/10.1303/aez.2008.219
. [all data]
Lis, Boczek, et al., 2004
Lis, A.; Boczek, E.; Góra, J.,
Chemical composition of the essential oils from fruits, leaves and flowers of the Amur cork tree (Phellodendron amurense Rupr.),
Flavour Fragr. J., 2004, 19, 6, 549-553, https://doi.org/10.1002/ffj.1349
. [all data]
Notes
Go To: Top, Normal alkane RI, non-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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