| SpectraBase Spectrum ID |
5XmAnWar78S |
| Name |
Cubebol |
| CAS Registry Number |
23445-02-5 |
| Classification |
Flavor, fragrance |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.198365456 u |
| Formula |
C15H26O |
| InChI |
InChI=1S/C15H26O/c1-9(2)11-6-5-10(3)15-8-7-14(4,16)13(15)12(11)15/h9-13,16H,5-8H2,1-4H3/t10-,11?,12?,13+,14-,15?/m1/s1 |
| InChIKey |
KONGRWVLXLWGDV-WATQRLBISA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Quality |
931 |
| Retention Index |
1681 |
| SMILES |
O[C@]1([C@]2(C3(C2C(CC[C@]3(C)[H])C(C)C)CC1)[H])C |
| SPLASH |
splash10-06r6-7910000000-671e138ea2106c5bdeb0 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(3S,3aR,3bR,4S,7R,7aR)-4-Isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]-\rbenzen-3-ol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_025366 |
