| SpectraBase Spectrum ID |
2maNh1twf6e |
| Name |
Cannabigerolic acid 3TMS |
| Classification |
Cannabis ingredient derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
576.348639884 u |
| Formula |
C31H56O4Si3 |
| InChI |
InChI=1S/C31H56O4Si3/c1-14-15-16-20-26-23-28(33-36(5,6)7)27(22-21-25(4)19-17-18-24(2)3)30(34-37(8,9)10)29(26)31(32)35-38(11,12)13/h18,21,23H,14-17,19-20,22H2,1-13H3/b25-21+ |
| InChIKey |
ORQYXZHFPIFJJN-NJNXFGOHSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
577.040 g/mol |
| Nominal Mass |
576 u |
| Quality |
926 |
| Retention Index |
4000 |
| SMILES |
C=1(C(=C(C(=CC1CCCCC)O[Si](C)(C)C)C\C=C\(CCC=C(C)C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)=O |
| SPLASH |
splash10-03di-3234690000-4b23f3642c76f824fe75 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
trimethylsilyl 3-((2E)-3,7-dimethylocta-2,6-dien-1-yl)-6-pentyl-2,4-bis((trimethylsilyl)oxy)benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014405 |
