CID 4101776

4-methyl-n-{1-[(3-methylphenyl)amino]-2-oxo-2-phenylethyl}benzamide

Structural Information

Molecular Formula
C23H22N2O2
SMILES
CC1=CC=C(C=C1)C(=O)NC(C(=O)C2=CC=CC=C2)NC3=CC=CC(=C3)C
InChI
InChI=1S/C23H22N2O2/c1-16-11-13-19(14-12-16)23(27)25-22(21(26)18-8-4-3-5-9-18)24-20-10-6-7-17(2)15-20/h3-15,22,24H,1-2H3,(H,25,27)
InChIKey
DLXSGSSTHQVPPB-UHFFFAOYSA-N
Compound name
4-methyl-N-[1-(3-methylanilino)-2-oxo-2-phenylethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.16812 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.17540 187.4
[M+Na]+ 381.15734 190.8
[M-H]- 357.16084 196.4
[M+NH4]+ 376.20194 198.3
[M+K]+ 397.13128 186.1
[M+H-H2O]+ 341.16538 177.3
[M+HCOO]- 403.16632 209.7
[M+CH3COO]- 417.18197 221.7
[M+Na-2H]- 379.14279 189.0
[M]+ 358.16757 185.7
[M]- 358.16867 185.7
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.