CID 314042

2-chloro-5-methoxybenzenesulfonamide

Structural Information

Molecular Formula

C₇H₈ClNO₃S

SMILES

COC1=CC(=C(C=C1)Cl)S(=O)(=O)N

InChI

InChI=1S/C7H8ClNO3S/c1-12-5-2-3-6(8)7(4-5)13(9,10)11/h2-4H,1H3,(H2,9,10,11)

InChIKey

IARIOWWBALBFKZ-UHFFFAOYSA-N

Compound name

2-chloro-5-methoxybenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 90
Patents: 220.99135 Da
Monoisotopic Mass: 0.7
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]+	221.99863	143.4
[M+Na]+	243.98057	155.3
[M+NH4]+	239.02517	151.2
[M+K]+	259.95451	148.4
[M-H]-	219.98407	144.5
[M+Na-2H]-	241.96602	148.8
[M]+	220.99080	146.1
[M]-	220.99190	146.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe