CID 4186019

2-amino-5-chloro-n-(4-chlorophenyl)benzamide

Structural Information

Molecular Formula
C13H10Cl2N2O
SMILES
C1=CC(=CC=C1NC(=O)C2=C(C=CC(=C2)Cl)N)Cl
InChI
InChI=1S/C13H10Cl2N2O/c14-8-1-4-10(5-2-8)17-13(18)11-7-9(15)3-6-12(11)16/h1-7H,16H2,(H,17,18)
InChIKey
IQZVPSBTHWPSIS-UHFFFAOYSA-N
Compound name
2-amino-5-chloro-N-(4-chlorophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

280.01703 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.02431 160.2
[M+Na]+ 303.00625 169.6
[M-H]- 279.00975 166.2
[M+NH4]+ 298.05085 176.9
[M+K]+ 318.98019 162.8
[M+H-H2O]+ 263.01429 154.6
[M+HCOO]- 325.01523 176.1
[M+CH3COO]- 339.03088 201.3
[M+Na-2H]- 300.99170 163.7
[M]+ 280.01648 161.4
[M]- 280.01758 161.4
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