CID 312702

N-(propan-2-yl)methanesulfonamide

Structural Information

Molecular Formula
C4H11NO2S
SMILES
CC(C)NS(=O)(=O)C
InChI
InChI=1S/C4H11NO2S/c1-4(2)5-8(3,6)7/h4-5H,1-3H3
InChIKey
DWGXVIXKIPFBJB-UHFFFAOYSA-N
Compound name
N-propan-2-ylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

910
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 125.6
[M+Na]+ 160.04028 133.2
[M-H]- 136.04378 126.5
[M+NH4]+ 155.08488 147.6
[M+K]+ 176.01422 132.7
[M+H-H2O]+ 120.04832 121.1
[M+HCOO]- 182.04926 143.7
[M+CH3COO]- 196.06491 173.1
[M+Na-2H]- 158.02573 129.8
[M]+ 137.05051 127.6
[M]- 137.05161 127.6
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