CID 3059478

Benzamide, 5-chloro-2-hydroxy-n-(2-(phenylthio)phenyl)-

Structural Information

Molecular Formula
C19H14ClNO2S
SMILES
C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)Cl)O
InChI
InChI=1S/C19H14ClNO2S/c20-13-10-11-17(22)15(12-13)19(23)21-16-8-4-5-9-18(16)24-14-6-2-1-3-7-14/h1-12,22H,(H,21,23)
InChIKey
UUDZSXXQKKCZRB-UHFFFAOYSA-N
Compound name
5-chloro-2-hydroxy-N-(2-phenylsulfanylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.04337 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.05065 178.8
[M+Na]+ 378.03259 186.9
[M-H]- 354.03609 187.5
[M+NH4]+ 373.07719 191.9
[M+K]+ 394.00653 179.1
[M+H-H2O]+ 338.04063 171.3
[M+HCOO]- 400.04157 192.4
[M+CH3COO]- 414.05722 189.3
[M+Na-2H]- 376.01804 180.7
[M]+ 355.04282 181.8
[M]- 355.04392 181.8
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.