| SpectraBase Spectrum ID |
8IBenLGMq12 |
| Name |
Abietinic acid TMS |
| Classification |
Resin acid derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
374.264106997 u |
| Formula |
C23H38O2Si |
| InChI |
InChI=1S/C23H38O2Si/c1-16(2)17-9-11-19-18(15-17)10-12-20-22(19,3)13-8-14-23(20,4)21(24)25-26(5,6)7/h10,15-16,19-20H,8-9,11-14H2,1-7H3/t19-,20?,22?,23+/m0/s1 |
| InChIKey |
RXWFRYPIQODUHW-NFXUCOAQSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
374.640 g/mol |
| Nominal Mass |
374 u |
| Quality |
964 |
| Retention Index |
2764 |
| SMILES |
[C@]12(C3(C([C@](C(O[Si](C)(C)C)=O)(CCC3)C)CC=C1C=C(CC2)C(C)C)C)[H] |
| SPLASH |
splash10-0a4l-5981000000-72294d236bfbcd422358 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Abietic acid TMS
trimethylsilyl (1R,4bR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-\rdecahydrophenanthrene-1-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032063 |
