CID 53219182

1261942-62-4

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 168.3
[M+Na]+ 313.11990 175.8
[M-H]- 289.12340 176.9
[M+NH4]+ 308.16450 182.8
[M+K]+ 329.09384 170.2
[M+H-H2O]+ 273.12794 159.4
[M+HCOO]- 335.12888 190.8
[M+CH3COO]- 349.14453 179.9
[M+Na-2H]- 311.10535 172.8
[M]+ 290.13013 168.8
[M]- 290.13123 168.8
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

No patent data available for this compound.