CID 459298

4-(o-hydroxybenzylamino)benzophenone

Structural Information

Molecular Formula
C20H17NO2
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)NCC3=CC=CC=C3O
InChI
InChI=1S/C20H17NO2/c22-19-9-5-4-8-17(19)14-21-18-12-10-16(11-13-18)20(23)15-6-2-1-3-7-15/h1-13,21-22H,14H2
InChIKey
PDENRVBYYSQUKN-UHFFFAOYSA-N
Compound name
[4-[(2-hydroxyphenyl)methylamino]phenyl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.12592 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.13320 170.8
[M+Na]+ 326.11514 176.5
[M-H]- 302.11864 179.0
[M+NH4]+ 321.15974 183.9
[M+K]+ 342.08908 170.8
[M+H-H2O]+ 286.12318 161.7
[M+HCOO]- 348.12412 193.5
[M+CH3COO]- 362.13977 204.9
[M+Na-2H]- 324.10059 175.5
[M]+ 303.12537 169.0
[M]- 303.12647 169.0
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.