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

4622
Patents

137.05106 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.05834 126.3
[M+Na]+ 160.04028 134.7
[M-H]- 136.04378 126.9
[M+NH4]+ 155.08488 148.2
[M+K]+ 176.01422 133.7
[M+H-H2O]+ 120.04832 122.4
[M+HCOO]- 182.04926 143.3
[M+CH3COO]- 196.06491 171.3
[M+Na-2H]- 158.02573 131.4
[M]+ 137.05051 127.3
[M]- 137.05161 127.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe