| SpectraBase Spectrum ID |
6ZthWF4H0QY |
| Name |
(1R,5R,9S)-Caryophylla-4(12),8(13)-dien-5alpha-ol |
| Classification |
Sesquiterpenoids |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
234.198365456 u |
| Formula |
C16H26O |
| InChI |
InChI=1S/C16H26O/c1-11-8-9-16(5,17)12(2)6-7-14-13(11)10-15(14,3)4/h13-14,17H,1-2,6-10H2,3-5H3/t13-,14-,16-/m1/s1 |
| InChIKey |
TYVFZZBSGKAAMK-IIAWOOMASA-N |
| Molecular Weight |
234.383 g/mol |
| Number of Peaks |
24 |
| SMILES |
O[C@]1(C(CC[C@]2(C(C[C@@]2(C(CC1)=C)[H])(C)C)[H])=C)C |
| SPLASH |
splash10-052o-9600000000-fa2ecf7c7fd7cff75ab2 |
| Source of Spectrum |
FF-3-39-IV (DOI: 10.1002/ffj.2730030108) |
| Synonyms |
Caryophylladienol
(1S,5R,9R)-5,10,10-trimethyl-2,6-dimethylenebicyclo[7.2.0]undecan-5-ol |
| Wiley ID |
1801159 |
