| SpectraBase Spectrum ID |
AVDUOkL79At |
| Name |
Cembrene A |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8+,18-12+,19-11+ |
| InChIKey |
VWSPQDDPRITBAM-GDVLXBNMSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
272.476 g/mol |
| Nominal Mass |
272 u |
| Quality |
958 |
| Retention Index |
1970 |
| SMILES |
C1(C(=C)C)C\C=C\(CC\C=C\(CC\C=C\(CC1)C)C)C |
| SPLASH |
splash10-014l-9600000000-24d6339300b99b26abe5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(R,1E,5E,9E)-1,5,9-Trimethyl-12-(prop-1-en-2-yl)cyclotetradeca-1,5,9-triene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029468 |
