SpectraBase Spectrum ID |
3YAnXLmrZhJ |
Name |
Cannabinol TFA |
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 |
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 |
991 |
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 |
splash10-0006-1339000000-c06bd9a9adb5d09d318c |
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_012791 |