CID 17876740

2-(2-amino-3-benzoyl-5-chlorophenyl)acetamide

Structural Information

Molecular Formula
C15H13ClN2O2
SMILES
C1=CC=C(C=C1)C(=O)C2=CC(=CC(=C2N)CC(=O)N)Cl
InChI
InChI=1S/C15H13ClN2O2/c16-11-6-10(7-13(17)19)14(18)12(8-11)15(20)9-4-2-1-3-5-9/h1-6,8H,7,18H2,(H2,17,19)
InChIKey
BNUTYMOAQFOMEB-UHFFFAOYSA-N
Compound name
2-(2-amino-3-benzoyl-5-chlorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

288.06656 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.07384 165.1
[M+Na]+ 311.05578 173.0
[M-H]- 287.05928 171.2
[M+NH4]+ 306.10038 180.4
[M+K]+ 327.02972 167.4
[M+H-H2O]+ 271.06382 158.4
[M+HCOO]- 333.06476 184.2
[M+CH3COO]- 347.08041 205.3
[M+Na-2H]- 309.04123 166.1
[M]+ 288.06601 164.9
[M]- 288.06711 164.9
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