| SpectraBase Spectrum ID |
4qAqaATKtc |
| Name |
Caryophyllene<14-hydroxy-4,5-dihydro-> |
| CAS Registry Number |
289621-83-6 |
| 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 |
222.198365456 u |
| Formula |
C15H26O |
| 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/C15H26O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h12-14,16H,1,4-10H2,2-3H3/t12-,13+,14+/m0/s1 |
| InChIKey |
QPKKKWDNDWSIRV-BFHYXJOUSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
122 |
| SMILES |
OC[C@]1(CCCC([C@@]2([C@@](CC1)(C(C2)(C)C)[H])[H])=C)[H] |
| SPLASH |
splash10-00kf-9300000000-42270eac17768c8d7ed4 |
| Source |
ex BETUAL PENDULA |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000281 |
