| SpectraBase Spectrum ID |
4lbU1ZnmiW1 |
| Name |
Cubenol<1-epi-> |
| CAS Registry Number |
19912-67-5 |
| 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 |
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/c1-10(2)13-6-5-12(4)15(16)8-7-11(3)9-14(13)15/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13+,14+,15+/m1/s1 |
| InChIKey |
COGPRPSWSKLKTF-QPSCCSFWSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
157 |
| SMILES |
O[C@@]12[C@]([C@@](CC[C@]2(C)[H])(C(C)C)[H])(C=C(CC1)C)[H] |
| SPLASH |
splash10-07wc-8900000000-9c19aea3b3a13341caa2 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000396 |
