| SpectraBase Spectrum ID |
8GA0dtH9LX6 |
| Name |
beta-Damascenone |
| CAS Registry Number |
23726-93-4 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
190.135765199 u |
| Formula |
C13H18O |
| InChI |
InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5+ |
| InChIKey |
POIARNZEYGURDG-FNORWQNLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
190.286 g/mol |
| Nominal Mass |
190 u |
| Quality |
845 |
| Retention Index |
1375 |
| SMILES |
C1(C(=C(C=CC1)C)C(\C=C\C)=O)(C)C |
| SPLASH |
splash10-01bc-9700000000-022cd41e8dbba6894420 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(E)-1-(2,6,6-Trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026409 |
