CID 5274071

Chembl3608697

Structural Information

Molecular Formula
C14H12ClNO3
SMILES
COC1=CC(=C(C=C1)O)C(=O)NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C14H12ClNO3/c1-19-11-5-6-13(17)12(8-11)14(18)16-10-4-2-3-9(15)7-10/h2-8,17H,1H3,(H,16,18)
InChIKey
HZCXJTZFWWWHFF-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)-2-hydroxy-5-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

277.05057 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.05785 158.8
[M+Na]+ 300.03979 167.6
[M-H]- 276.04329 164.8
[M+NH4]+ 295.08439 175.0
[M+K]+ 316.01373 162.7
[M+H-H2O]+ 260.04783 152.5
[M+HCOO]- 322.04877 178.1
[M+CH3COO]- 336.06442 197.2
[M+Na-2H]- 298.02524 163.0
[M]+ 277.05002 161.7
[M]- 277.05112 161.7
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.