CID 2757335

Tert-butylsulfonamide

Structural Information

Molecular Formula

C₄H₁₁NO₂S

SMILES

CC(C)(C)S(=O)(=O)N

InChI

InChI=1S/C4H11NO2S/c1-4(2,3)8(5,6)7/h1-3H3,(H2,5,6,7)

InChIKey

GWJSQKNYHPYZRN-UHFFFAOYSA-N

Compound name

2-methylpropane-2-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 3184
Patents: 137.05106 Da
Monoisotopic Mass: -0.1
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]+	138.05834	129.9
[M+Na]+	160.04028	138.1
[M+NH4]+	155.08488	137.1
[M+K]+	176.01422	133.4
[M-H]-	136.04378	128.0
[M+Na-2H]-	158.02573	132.2
[M]+	137.05051	130.8
[M]-	137.05161	130.8

Literature stripe

literature stripe

Patent stripe

patents stripe