CID 49873141

Cannabidiphorol

Structural Information

Molecular Formula
C23H34O2
SMILES
CCCCCCCC1=CC(=C(C(=C1)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C)O
InChI
InChI=1S/C23H34O2/c1-5-6-7-8-9-10-18-14-21(24)23(22(25)15-18)20-13-17(4)11-12-19(20)16(2)3/h13-15,19-20,24-25H,2,5-12H2,1,3-4H3/t19-,20+/m0/s1
InChIKey
GGHRHCGOMWNLCE-VQTJNVASSA-N
Compound name
5-heptyl-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]benzene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

283
Patents

342.2559 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.26318 189.2
[M+Na]+ 365.24512 201.0
[M+NH4]+ 360.28972 196.0
[M+K]+ 381.21906 192.9
[M-H]- 341.24862 192.4
[M+Na-2H]- 363.23057 193.1
[M]+ 342.25535 191.8
[M]- 342.25645 191.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe