| SpectraBase Spectrum ID |
JyihVNinv8z |
| Name |
7.alpha.(S),9.alpha.(R)-Diacetoxy-8.alpha.(R)-hydroxy-1(12)-caryophyllene |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.209324061 u |
| Formula |
C19H30O5 |
| InChI |
InChI=1S/C19H30O5/c1-11-7-8-16(23-12(2)20)19(6,22)17(24-13(3)21)9-15-14(11)10-18(15,4)5/h14-17,22H,1,7-10H2,2-6H3/t14-,15-,16-,17+,19-/m1/s1 |
| InChIKey |
GCWOSVDDCQPPBW-ZQOJQMTGSA-N |
| Molecular Weight |
338.444 g/mol |
| SMILES |
[C@]12([C@](C(CC[C@]([C@]([C@](C2)(OC(=O)C)[H])(O)C)(OC(=O)C)[H])=C)([H])CC1(C)C)[H] |
