SpectraBase Spectrum ID |
8FCIRGvkaMy |
Name |
CBDB |
CAS Registry Number |
60113-11-3 |
Classification |
Phytocannabinoid |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
300.208930140 u |
Formula |
C20H28O2 |
InChI |
InChI=1S/C20H28O2/c1-5-6-7-15-11-18(21)20(19(22)12-15)17-10-14(4)8-9-16(17)13(2)3/h10-12,16-17,21-22H,2,5-9H2,1,3-4H3/t16-,17+/m0/s1 |
InChIKey |
WBRXESQKGXYDOL-DLBZAZTESA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
300.442 g/mol |
Nominal Mass |
300 u |
Quality |
992 |
Retention Index |
2221 |
SMILES |
OC1=C(C(=CC(=C1)CCCC)O)[C@]1([C@](C(=C)C)(CCC(=C1)C)[H])[H] |
SPLASH |
splash10-014i-1590000000-6486f1e6fbbe970ffb75 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
CBD-C4
Cannabidibutol
Cannabidiol-C4
(1R-trans)-5-butyl-2-[3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-1,3-benzenediol |
Technique |
GC/MS |
Wiley ID |
DD2024_029658 |