CID 13343581

N-methylbutane-1-sulfonamide

Structural Information

Molecular Formula

C₅H₁₃NO₂S

SMILES

CCCCS(=O)(=O)NC

InChI

InChI=1S/C5H13NO2S/c1-3-4-5-9(7,8)6-2/h6H,3-5H2,1-2H3

InChIKey

CJUPBDDCEQLSBF-UHFFFAOYSA-N

Compound name

N-methylbutane-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 284
Patents: 151.0667 Da
Monoisotopic Mass: 0.6
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]+	152.07398	132.5
[M+Na]+	174.05592	141.1
[M+NH4]+	169.10052	139.9
[M+K]+	190.02986	134.8
[M-H]-	150.05942	131.4
[M+Na-2H]-	172.04137	135.2
[M]+	151.06615	133.6
[M]-	151.06725	133.6

Literature stripe

literature stripe

Patent stripe

patents stripe