CID 121676

Benzylbiphenylol

Structural Information

Molecular Formula
C19H16O
SMILES
C1=CC=C(C=C1)CC2=C(C(=CC=C2)O)C3=CC=CC=C3
InChI
InChI=1S/C19H16O/c20-18-13-7-12-17(14-15-8-3-1-4-9-15)19(18)16-10-5-2-6-11-16/h1-13,20H,14H2
InChIKey
BMMNUXLWZAHXNL-UHFFFAOYSA-N
Compound name
3-benzyl-2-phenylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

61
Patents

260.12012 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.12740 162.0
[M+Na]+ 283.10934 179.8
[M+NH4]+ 278.15394 172.3
[M+K]+ 299.08328 169.5
[M-H]- 259.11284 170.1
[M+Na-2H]- 281.09479 175.2
[M]+ 260.11957 167.3
[M]- 260.12067 167.3
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