Caryophylla-4,8-dien-5-ol
- Formula: C15H24O
- Molecular weight: 220.3505
- IUPAC Standard InChI: InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3/t12-,13-,14+/m0/s1
- IUPAC Standard InChIKey: CIIYOYPOMGIECX-MELADBBJSA-N
- 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:
- Stereoisomers:
- Caryophylla-4(12),8(13)-dien-5α-ol
- 10,10-Dimethyl-2,6-dimethylenebicyclo[7.2.0]undecan-5β-ol
- Caryophylladienol I
- Caryophylla-3(15),7(14)-dien-6-ol
- Caryophylla-4(12),8(13)-dien-5-β-ol
- β-Caryophylla-4(14),8(15)-dien-5-ol
- Caryophylla-4(12),8(13)-dien-5α-ol
- Caryophylla-4(15),8(13)-dien-5-α-ol
- Cariophylladienol I
- Caryophylladienol I
- Caryophylla-4(12),8(13)-diene-5β-ol
- Caryophylla-4(12),8(13)-dien-5-ol
- Information on this page:
- Other data available:
- Options:
Normal alkane RI, non-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 |
|---|---|---|
| Active phase | HP-1 | CP Sil 8 CB |
| Column length (m) | 30. | 50. |
| Carrier gas | He | He |
| Substrate | ||
| Column diameter (mm) | 0.2 | 0.32 |
| Phase thickness (μm) | 0.33 | 0.25 |
| Program | 60C(5min) => 3C/min => 180C => 20C/min => 280C(10min) | 60C(1min) => 5C/min => 160C => 10C/min => 250C(5min) |
| I | 1634. | 1641. |
| Reference | Merle, Verdeguer, et al., 2007 | Mockute, Nivinskiene, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-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.
Merle, Verdeguer, et al., 2007
Merle, H.; Verdeguer, M.; Blázquez, M.A.; Boira, H.,
Chemical composition of the essential oils from Eriocephalus africanus L. var. africanus populations growing in Spain,
Flavour Fragr. J., 2007, 22, 6, 461-464, https://doi.org/10.1002/ffj.1821
. [all data]
Mockute, Nivinskiene, et al., 2003
Mockute, D.; Nivinskiene, O.; Bernotiene, G.; Butkiene, R.,
The cis-thujone chemotype of Salvia officinalis L. essential oils,
Chemija, 2003, 14, 4, 216-220. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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