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

17
Patents

298.19327 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.200546 171.6
[M+Na]+ 321.182488 179.6
[M-H]- 297.185994 176.6
[M+NH4]+ 316.227093 186.6
[M+K]+ 337.156428 175.2
[M+H-H2O]+ 281.190530 165.1
[M+HCOO]- 343.191471 189.3
[M+CH3COO]- 357.207121 208.1
[M+Na-2H]- 319.167936 169.0
[M]+ 298.19272142 173.2
[M]- 298.19381858 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