CID 730081

N-(4-acetamidophenyl)-2-methylbenzamide

Structural Information

Molecular Formula
C16H16N2O2
SMILES
CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C16H16N2O2/c1-11-5-3-4-6-15(11)16(20)18-14-9-7-13(8-10-14)17-12(2)19/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKey
PLTUDBPVOJHPFT-UHFFFAOYSA-N
Compound name
N-(4-acetamidophenyl)-2-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

268.1212 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.128476 162.0
[M+Na]+ 291.110418 167.9
[M-H]- 267.113924 168.9
[M+NH4]+ 286.155023 177.7
[M+K]+ 307.084358 164.6
[M+H-H2O]+ 251.118460 154.0
[M+HCOO]- 313.119401 186.6
[M+CH3COO]- 327.135051 203.2
[M+Na-2H]- 289.095866 165.9
[M]+ 268.12065142 161.2
[M]- 268.12174858 161.2
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.