CID 4134159

N-(2,3-dichlorophenyl)-2-[(3-methylphenyl)sulfanyl]acetamide

Structural Information

Molecular Formula
C15H13Cl2NOS
SMILES
CC1=CC(=CC=C1)SCC(=O)NC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C15H13Cl2NOS/c1-10-4-2-5-11(8-10)20-9-14(19)18-13-7-3-6-12(16)15(13)17/h2-8H,9H2,1H3,(H,18,19)
InChIKey
LMAUVIIHEVHRFC-UHFFFAOYSA-N
Compound name
N-(2,3-dichlorophenyl)-2-(3-methylphenyl)sulfanylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.0095 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.01678 172.2
[M+Na]+ 347.99872 187.6
[M+NH4]+ 343.04332 181.7
[M+K]+ 363.97266 176.2
[M-H]- 324.00222 177.6
[M+Na-2H]- 345.98417 180.8
[M]+ 325.00895 177.2
[M]- 325.01005 177.2
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.