CID 78779

N-(4-amino-5-chloro-2-hydroxyphenyl)benzamide

Structural Information

Molecular Formula
C13H11ClN2O2
SMILES
C1=CC=C(C=C1)C(=O)NC2=C(C=C(C(=C2)Cl)N)O
InChI
InChI=1S/C13H11ClN2O2/c14-9-6-11(12(17)7-10(9)15)16-13(18)8-4-2-1-3-5-8/h1-7,17H,15H2,(H,16,18)
InChIKey
HYPJTFZIRMSKAK-UHFFFAOYSA-N
Compound name
N-(4-amino-5-chloro-2-hydroxyphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

21
Patents

262.0509 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.058176 156.5
[M+Na]+ 285.040118 165.0
[M-H]- 261.043624 162.1
[M+NH4]+ 280.084723 172.8
[M+K]+ 301.014058 159.4
[M+H-H2O]+ 245.048160 150.3
[M+HCOO]- 307.049101 176.3
[M+CH3COO]- 321.064751 196.7
[M+Na-2H]- 283.025566 160.5
[M]+ 262.05035142 156.0
[M]- 262.05144858 156.0
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