CID 2094800

4-cyano-n-(2-methylphenyl)benzamide

Structural Information

Molecular Formula
C15H12N2O
SMILES
CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C#N
InChI
InChI=1S/C15H12N2O/c1-11-4-2-3-5-14(11)17-15(18)13-8-6-12(10-16)7-9-13/h2-9H,1H3,(H,17,18)
InChIKey
OAUQYEIHNYICBR-UHFFFAOYSA-N
Compound name
4-cyano-N-(2-methylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.09496 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.10224 157.9
[M+Na]+ 259.08418 171.2
[M+NH4]+ 254.12878 162.8
[M+K]+ 275.05812 160.4
[M-H]- 235.08768 155.3
[M+Na-2H]- 257.06963 164.0
[M]+ 236.09441 158.2
[M]- 236.09551 158.2
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.