| SpectraBase Spectrum ID |
5XD7RpuxITg |
| Name |
Abietadiene |
| CAS Registry Number |
35241-40-8 |
| Classification |
Diterpene |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h8,13-14,17-18H,6-7,9-12H2,1-5H3 |
| InChIKey |
BBPXZLJCPUPNGH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
272.476 g/mol |
| Nominal Mass |
272 u |
| Quality |
992 |
| Retention Index |
2049 |
| SMILES |
C12(C3C(C=C(CC3)C(C)C)=CCC1C(CCC2)(C)C)C |
| SPLASH |
splash10-05i0-3940000000-dc1b8101b4474ea6a459 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(4aS,4bR,10aS)-7-Isopropyl-1,1,4a-trimethyl-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029592 |
