CID 3492375

2-chloro-2'-hydroxy-5'-nitrobenzanilide

Structural Information

Molecular Formula
C13H9ClN2O4
SMILES
C1=CC=C(C(=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl
InChI
InChI=1S/C13H9ClN2O4/c14-10-4-2-1-3-9(10)13(18)15-11-7-8(16(19)20)5-6-12(11)17/h1-7,17H,(H,15,18)
InChIKey
GGSBRCMTJJWEGJ-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-hydroxy-5-nitrophenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.0251 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.03238 160.6
[M+Na]+ 315.01432 167.6
[M-H]- 291.01782 166.2
[M+NH4]+ 310.05892 174.8
[M+K]+ 330.98826 159.0
[M+H-H2O]+ 275.02236 158.7
[M+HCOO]- 337.02330 180.8
[M+CH3COO]- 351.03895 193.1
[M+Na-2H]- 312.99977 166.3
[M]+ 292.02455 160.4
[M]- 292.02565 160.4
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

No patent data available for this compound.