CID 2118137

2-chloro-n-(3-acetamidophenyl)acetamide

Structural Information

Molecular Formula
C10H11ClN2O2
SMILES
CC(=O)NC1=CC(=CC=C1)NC(=O)CCl
InChI
InChI=1S/C10H11ClN2O2/c1-7(14)12-8-3-2-4-9(5-8)13-10(15)6-11/h2-5H,6H2,1H3,(H,12,14)(H,13,15)
InChIKey
OFCXEGVJCMFKGG-UHFFFAOYSA-N
Compound name
N-(3-acetamidophenyl)-2-chloroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

226.0509 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.058176 148.1
[M+Na]+ 249.040118 155.2
[M-H]- 225.043624 151.8
[M+NH4]+ 244.084723 166.5
[M+K]+ 265.014058 151.7
[M+H-H2O]+ 209.048160 142.6
[M+HCOO]- 271.049101 168.7
[M+CH3COO]- 285.064751 191.8
[M+Na-2H]- 247.025566 152.6
[M]+ 226.05035142 149.4
[M]- 226.05144858 149.4
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

patents stripe