| SpectraBase Spectrum ID |
2of3nhv705I |
| Name |
6,6,9-Trimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-1-yl benzoate |
| Classification |
Semi-synthetic cannabinoid derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
420.266445016 u |
| Formula |
C28H36O3 |
| InChI |
InChI=1S/C28H36O3/c1-5-6-8-11-20-17-24(30-27(29)21-12-9-7-10-13-21)26-22-16-19(2)14-15-23(22)28(3,4)31-25(26)18-20/h7,9-10,12-13,17-19,22-23H,5-6,8,11,14-16H2,1-4H3/t19?,22-,23-/m1/s1 |
| InChIKey |
ZFLLUTGHQZZCMO-QENMJEOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
420.593 g/mol |
| Nominal Mass |
420 u |
| Quality |
996 |
| Retention Index |
3145 |
| SMILES |
[C@]12(C3=C(OC([C@@]2(CCC(C1)C)[H])(C)C)C=C(C=C3OC(C=1C=CC=CC1)=O)CCCCC)[H] |
| SPLASH |
splash10-0a4i-2942000000-e20c98748e682f84943d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6,6,9-trimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-1-yl benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034562 |
![6,6,9-trimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-1-yl benzoate](/api/spectrum/2of3nhv705I/structure.png?h=300&w=458 "6,6,9-trimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-1-yl benzoate")
