CID 55326

2-methyl-4'-phenylbenzophenone

Structural Information

Molecular Formula
C20H16O
SMILES
CC1=CC=CC=C1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H16O/c1-15-7-5-6-10-19(15)20(21)18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2-14H,1H3
InChIKey
VQUIWJXQTBMPAE-UHFFFAOYSA-N
Compound name
(2-methylphenyl)-(4-phenylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

272.12012 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.127396 163.5
[M+Na]+ 295.109338 170.7
[M-H]- 271.112844 173.2
[M+NH4]+ 290.153943 179.1
[M+K]+ 311.083278 165.2
[M+H-H2O]+ 255.117380 154.7
[M+HCOO]- 317.118321 186.5
[M+CH3COO]- 331.133971 175.6
[M+Na-2H]- 293.094786 168.1
[M]+ 272.11957142 162.7
[M]- 272.12066858 162.7
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

patents stripe