CID 136413

N-benzoylbenzamide

Structural Information

Molecular Formula
C14H11NO2
SMILES
C1=CC=C(C=C1)C(=O)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C14H11NO2/c16-13(11-7-3-1-4-8-11)15-14(17)12-9-5-2-6-10-12/h1-10H,(H,15,16,17)
InChIKey
ZHDORMMHAKXTPT-UHFFFAOYSA-N
Compound name
N-benzoylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2802
Patents

225.07898 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.08626 149.2
[M+Na]+ 248.06820 155.0
[M-H]- 224.07170 155.8
[M+NH4]+ 243.11280 166.3
[M+K]+ 264.04214 152.0
[M+H-H2O]+ 208.07624 141.6
[M+HCOO]- 270.07718 173.5
[M+CH3COO]- 284.09283 189.7
[M+Na-2H]- 246.05365 155.2
[M]+ 225.07843 147.6
[M]- 225.07953 147.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe