| SpectraBase Spectrum ID |
9Cosztdui78 |
| Name |
9-epi-(E)-Caryophyllene |
| CAS Registry Number |
68832-35-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H24 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/t13-,14+/m0/s1 |
| InChIKey |
NPNUFJAVOOONJE-UONOGXRCSA-N |
| Molecular Weight |
204.357 g/mol |
| SMILES |
[C@@]12(CCC(=CCCC([C@@]2(CC1(C)C)[H])=C)C)[H] |
| SPLASH |
splash10-052f-9800000000-fd3b27f1bf29ec9fcbe7 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Caryophyllene<9-epi-(E)-> |
| Wiley ID |
1886044 |
