CID 4102612

4-(2-oxo-2-phenylacetyl)benzamide

Structural Information

Molecular Formula
C15H11NO3
SMILES
C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C(=O)N
InChI
InChI=1S/C15H11NO3/c16-15(19)12-8-6-11(7-9-12)14(18)13(17)10-4-2-1-3-5-10/h1-9H,(H2,16,19)
InChIKey
MQHZKQVBPBHWBZ-UHFFFAOYSA-N
Compound name
4-(2-oxo-2-phenylacetyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.0739 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.081176 155.7
[M+Na]+ 276.063118 161.7
[M-H]- 252.066624 161.9
[M+NH4]+ 271.107723 171.3
[M+K]+ 292.037058 158.7
[M+H-H2O]+ 236.071160 148.0
[M+HCOO]- 298.072101 178.3
[M+CH3COO]- 312.087751 196.8
[M+Na-2H]- 274.048566 158.2
[M]+ 253.07335142 154.1
[M]- 253.07444858 154.1
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.