CID 22925894

93919-14-3

Structural Information

Molecular Formula
C20H26O2
SMILES
CC1=CC(=CC(=C1O)C)C(C2=CC(=C(C(=C2)C)O)C)C(C)C
InChI
InChI=1S/C20H26O2/c1-11(2)18(16-7-12(3)19(21)13(4)8-16)17-9-14(5)20(22)15(6)10-17/h7-11,18,21-22H,1-6H3
InChIKey
ODVXUYPWFWVHGW-UHFFFAOYSA-N
Compound name
4-[1-(4-hydroxy-3,5-dimethylphenyl)-2-methylpropyl]-2,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

298.19327 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.20055 171.6
[M+Na]+ 321.18249 179.6
[M-H]- 297.18599 176.6
[M+NH4]+ 316.22709 186.6
[M+K]+ 337.15643 175.2
[M+H-H2O]+ 281.19053 165.1
[M+HCOO]- 343.19147 189.3
[M+CH3COO]- 357.20712 208.1
[M+Na-2H]- 319.16794 169.0
[M]+ 298.19272 173.2
[M]- 298.19382 173.2
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