CID 4961880

2-chloro-n-(2,3-dimethyl-5-sulfamoylphenyl)acetamide

Structural Information

Molecular Formula

C₁₀H₁₃ClN₂O₃S

SMILES

CC1=CC(=CC(=C1C)NC(=O)CCl)S(=O)(=O)N

InChI

InChI=1S/C10H13ClN2O3S/c1-6-3-8(17(12,15)16)4-9(7(6)2)13-10(14)5-11/h3-4H,5H2,1-2H3,(H,13,14)(H2,12,15,16)

InChIKey

CJJOBIGZZCEYBH-UHFFFAOYSA-N

Compound name

2-chloro-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 276.03354 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	277.040816	157.4
[M+Na]+	299.022758	166.4
[M-H]-	275.026264	161.4
[M+NH4]+	294.067363	174.5
[M+K]+	314.996698	161.5
[M+H-H2O]+	259.030800	152.5
[M+HCOO]-	321.031741	171.5
[M+CH3COO]-	335.047391	199.0
[M+Na-2H]-	297.008206	158.9
[M]+	276.03299142	161.2
[M]-	276.03408858	161.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.