CID 53219182

4-(4-benzyloxyphenyl)-2-methylphenol

Structural Information

Molecular Formula
C20H18O2
SMILES
CC1=C(C=CC(=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)O
InChI
InChI=1S/C20H18O2/c1-15-13-18(9-12-20(15)21)17-7-10-19(11-8-17)22-14-16-5-3-2-4-6-16/h2-13,21H,14H2,1H3
InChIKey
KWJYGJDDTZNRHB-UHFFFAOYSA-N
Compound name
2-methyl-4-(4-phenylmethoxyphenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.13068 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.13796 169.7
[M+Na]+ 313.11990 187.1
[M+NH4]+ 308.16450 179.1
[M+K]+ 329.09384 177.3
[M-H]- 289.12340 177.3
[M+Na-2H]- 311.10535 181.8
[M]+ 290.13013 174.7
[M]- 290.13123 174.7
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

No patent data available for this compound.