CID 75040

4-benzoylbiphenyl

Structural Information

Molecular Formula
C19H14O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H14O/c20-19(17-9-5-2-6-10-17)18-13-11-16(12-14-18)15-7-3-1-4-8-15/h1-14H
InChIKey
LYXOWKPVTCPORE-UHFFFAOYSA-N
Compound name
phenyl-(4-phenylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

11
References

32596
Patents

258.10446 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.11174 159.2
[M+Na]+ 281.09368 165.9
[M-H]- 257.09718 168.7
[M+NH4]+ 276.13828 175.1
[M+K]+ 297.06762 160.6
[M+H-H2O]+ 241.10172 150.5
[M+HCOO]- 303.10266 182.6
[M+CH3COO]- 317.11831 171.4
[M+Na-2H]- 279.07913 165.1
[M]+ 258.10391 157.7
[M]- 258.10501 157.7
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.