| SpectraBase Spectrum ID |
8XLUk2qe1wF |
| Name |
Spathulenol |
| CAS Registry Number |
6750-60-3 |
| Classification |
Pheromone |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
220.182715392 u |
| Formula |
C15H24O |
| InChI |
InChI=1S/C15H24O/c1-9-5-6-11-13(14(11,2)3)12-10(9)7-8-15(12,4)16/h10-13,16H,1,5-8H2,2-4H3/t10-,11+,12+,13+,15-/m0/s1 |
| InChIKey |
FRMCCTDTYSRUBE-BGPZULBFSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
220.356 g/mol |
| Nominal Mass |
220 u |
| Quality |
952 |
| Retention Index |
1580 |
| SMILES |
O[C@@]1([C@]2([C@]3([C@](C3(C)C)(CCC([C@@]2(CC1)[H])=C)[H])[H])[H])C |
| SPLASH |
splash10-0a4l-5910000000-93d9c9c3e19b97c79390 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029992 |
