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

31
Patents

288.06656 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.073836 165.1
[M+Na]+ 311.055778 173.0
[M-H]- 287.059284 171.2
[M+NH4]+ 306.100383 180.4
[M+K]+ 327.029718 167.4
[M+H-H2O]+ 271.063820 158.4
[M+HCOO]- 333.064761 184.2
[M+CH3COO]- 347.080411 205.3
[M+Na-2H]- 309.041226 166.1
[M]+ 288.06601142 164.9
[M]- 288.06710858 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