| SpectraBase Spectrum ID |
A9IrisHKKF0 |
| Name |
Cannabinol TFA |
| Classification |
Cannabis ingredient derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
406.175579151 u |
| Formula |
C23H25F3O3 |
| InChI |
InChI=1S/C23H25F3O3/c1-5-6-7-8-15-12-18(28-21(27)23(24,25)26)20-16-11-14(2)9-10-17(16)22(3,4)29-19(20)13-15/h9-13H,5-8H2,1-4H3 |
| InChIKey |
JPFWCOXQOMQJPC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
406.445 g/mol |
| Nominal Mass |
406 u |
| Quality |
993 |
| Retention Index |
2984 |
| SMILES |
C1=2C3=C(OC(C2C=CC(=C1)C)(C)C)C=C(C=C3OC(C(F)(F)F)=O)CCCCC |
| SPLASH |
splash10-0006-1239000000-870173b1b48ce6d6fa98 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Cannabinol,trifluoroacetate
6,6,9-trimethyl-3-pentyl-6H-benzo[c]chromen-1-yl trifluoroacetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021676 |
