CID 215263

Brn 3067758

Structural Information

Molecular Formula
C16H13Cl2NO4
SMILES
CCOC(=O)C1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)O
InChI
InChI=1S/C16H13Cl2NO4/c1-2-23-16(22)11-7-9(3-6-14(11)20)15(21)19-10-4-5-12(17)13(18)8-10/h3-8,20H,2H2,1H3,(H,19,21)
InChIKey
GETLFRAMDAGVEM-UHFFFAOYSA-N
Compound name
ethyl 5-[(3,4-dichlorophenyl)carbamoyl]-2-hydroxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.02216 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.029436 174.1
[M+Na]+ 376.011378 183.2
[M-H]- 352.014884 179.6
[M+NH4]+ 371.055983 187.9
[M+K]+ 391.985318 177.5
[M+H-H2O]+ 336.019420 168.6
[M+HCOO]- 398.020361 187.2
[M+CH3COO]- 412.036011 210.4
[M+Na-2H]- 373.996826 174.9
[M]+ 353.02161142 179.7
[M]- 353.02270858 179.7
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.