| SpectraBase Spectrum ID |
AyI52JF81gp |
| Name |
Calamenene<5-hydroxy-cis-> |
| CAS Registry Number |
81275-80-1 |
| 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 |
218.167065327 u |
| Formula |
C15H22O |
| 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/C15H22O/c1-9(2)12-7-5-10(3)13-8-6-11(4)15(16)14(12)13/h6,8-10,12,16H,5,7H2,1-4H3/t10-,12-/m1/s1 |
| InChIKey |
YXYMGKMWKSMRAB-ZYHUDNBSSA-N |
| Molecular Weight |
218.340 g/mol |
| Nominal Mass |
218 u |
| Number of Peaks |
130 |
| SMILES |
Oc1c(ccc2c1[C@](CC[C@]2(C)[H])(C(C)C)[H])C |
| SPLASH |
splash10-004i-1900000000-7d41454c46908aa76aeb |
| Source |
ex BAZZANIA TRILOBATA Ex KOENIG |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000239 |
