CID 16777083

4-(3,4-dichlorobenzamido)-2-hydroxybenzoic acid

Structural Information

Molecular Formula
C14H9Cl2NO4
SMILES
C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)C(=O)O)O)Cl)Cl
InChI
InChI=1S/C14H9Cl2NO4/c15-10-4-1-7(5-11(10)16)13(19)17-8-2-3-9(14(20)21)12(18)6-8/h1-6,18H,(H,17,19)(H,20,21)
InChIKey
XNBHUADALNBFGC-UHFFFAOYSA-N
Compound name
4-[(3,4-dichlorobenzoyl)amino]-2-hydroxybenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.99088 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.99816 164.7
[M+Na]+ 347.98010 174.1
[M-H]- 323.98360 169.2
[M+NH4]+ 343.02470 178.8
[M+K]+ 363.95404 168.1
[M+H-H2O]+ 307.98814 159.9
[M+HCOO]- 369.98908 177.0
[M+CH3COO]- 384.00473 203.0
[M+Na-2H]- 345.96555 166.2
[M]+ 324.99033 167.9
[M]- 324.99143 167.9
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

No patent data available for this compound.