CID 226310

4-(1h-pyrrol-1-yl)benzenesulfonamide

Structural Information

Molecular Formula

C₁₀H₁₀N₂O₂S

SMILES

C1=CN(C=C1)C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C10H10N2O2S/c11-15(13,14)10-5-3-9(4-6-10)12-7-1-2-8-12/h1-8H,(H2,11,13,14)

InChIKey

HEROWGICZZJWKP-UHFFFAOYSA-N

Compound name

4-pyrrol-1-ylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 382
Patents: 222.0463 Da
Monoisotopic Mass: 1.6
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]+	223.05358	146.8
[M+Na]+	245.03552	158.2
[M+NH4]+	240.08012	154.6
[M+K]+	261.00946	152.8
[M-H]-	221.03902	149.4
[M+Na-2H]-	243.02097	154.0
[M]+	222.04575	149.5
[M]-	222.04685	149.5

Literature stripe

literature stripe

Patent stripe

patents stripe