Cannabigerol

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Systematic / IUPAC Name: 2-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-5-pentyl-1,3-benzenediol

ID: Reference5731

Other Names: 1,3-Benzenediol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-;
1,3-Benzenediol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-, (E)-;
2-[(2E)-3,7-Dimethyl-2,6-octadienyl]-5-pentyl-1,3-benzenediol;
2-[(2E)-3,7-Dimethylocta-2,6-dienyl]-5-pentylbenzene-1,3-diol;
Resorcinol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-

Formula: C21H32O2

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

Cannabigerol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 158
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/3/2016 8:49:23 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H32O2/c1-5-6-7-11-18-14-20(22)19(21(23)15-18)13-12-17(4)10-8-9-16(2)3/h9,12,14-15,22-23H,5-8,10-11,13H2,1-4H3/b17-12+
InChI Key QXACEHWTBCFNSA-SFQUDFHCSA-N
Canonical SMILES CCCCCC1=CC(=C(C(=C1)O)CC=C(C)CCC=C(C)C)O
CAS 25654313
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Other Names 1,3-Benzenediol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-;
1,3-Benzenediol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-, (E)-;
2-[(2E)-3,7-Dimethyl-2,6-octadienyl]-5-pentyl-1,3-benzenediol;
2-[(2E)-3,7-Dimethylocta-2,6-dienyl]-5-pentylbenzene-1,3-diol;
Resorcinol, 2-(3,7-dimethyl-2,6-octadienyl)-5-pentyl-

In Other Databases

KEGG C20219
Wikipedia Cannabigerol
ChemIDPlus 025654313
PubChem 5315659
ChEBI CHEBI:69477
ChemSpider 4474921