| SpectraBase Spectrum ID |
WMG3d7ea08 |
| Name |
Caryophyllene<14-hydroxy-9-epi-(E)-> |
| CAS Registry Number |
79768-25-5 |
| 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 |
220.182715392 u |
| Formula |
C15H24O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C15H24O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h6,13-14,16H,1,4-5,7-10H2,2-3H3/b12-6+/t13-,14-/m1/s1 |
| InChIKey |
MGIQTXDHQJGPEZ-BARLUBHISA-N |
| Molecular Weight |
220.356 g/mol |
| Nominal Mass |
220 u |
| Number of Peaks |
143 |
| SMILES |
OC\C1=C\CCC([C@]2(CC([C@@]2(CC1)[H])(C)C)[H])=C |
| SPLASH |
splash10-0006-9500000000-37587ea89d3561cdba16 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000282 |
