cis-3-Hexenyl iso-butyrate
- Formula: C10H18O2
- Molecular weight: 170.2487
- IUPAC Standard InChI: InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5-
- IUPAC Standard InChIKey: OSMAJVWUIUORGC-WAYWQWQTSA-N
- CAS Registry Number: 41519-23-7
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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- Stereoisomers:
- Other names: Propanoic acid, 2-methyl-, 3-hexenyl ester, (Z)-; ENT 33348; β,γ-Hexenyl isobutanoate; (Z)-Hex-3-en-1-yl isobutyrate; (3Z)-3-Hexenyl 2-methylpropanoate; cis-3-Hexenyl 2-methylbutyrate; (Z)-3-Hexenyl isobutanoate; (Z)-Hex-3-enyl isobutyrate; (Z)-3-hexenyl 2-methylpropanoate
- Information on this page:
- Other data available:
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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 |
|---|---|---|
| Active phase | HP-5 | HP-5 |
| Column length (m) | 30. | 30. |
| Carrier gas | H2 | He |
| Substrate | ||
| Column diameter (mm) | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 |
| Tstart (C) | 50. | 50. |
| Tend (C) | 280. | 300. |
| Heat rate (K/min) | 4. | 5. |
| Initial hold (min) | 2. | 5. |
| Final hold (min) | 10. | 5. |
| I | 1145. | 1142. |
| Reference | Pino, Sauri-Duch, et al., 2006 | Figuérédo, Cabassu, et al., 2005 |
| 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.
Pino, Sauri-Duch, et al., 2006
Pino, J.; Sauri-Duch, E.; Marbot, R.,
Changes in volatile compounds of Habanero chile pepper (Capsicum chinense Jack. cv. Habanero) at two ripening stages,
Food Chem., 2006, 94, 3, 394-398, https://doi.org/10.1016/j.foodchem.2004.11.040
. [all data]
Figuérédo, Cabassu, et al., 2005
Figuérédo, G.; Cabassu, P.; Chalchat, J.-C.; Pasquier, B.,
Studies of Mediterranean oregano populations- V. Chemical composition of essential oils of oregano: Origanum syriacum L. var. bevanii (Holmes) Ietswaart, O. syriacum L. var. sinaicum (Boiss.) Ietswaart, and O. syriacum L. var. syriacum from Lebanon and Israel,
Flavour Fragr. J., 2005, 20, 164-168. [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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