CID 62615

Dimethylsulfamic acid

Structural Information

Molecular Formula
C2H7NO3S
SMILES
CN(C)S(=O)(=O)O
InChI
InChI=1S/C2H7NO3S/c1-3(2)7(4,5)6/h1-2H3,(H,4,5,6)
InChIKey
YGNOYUCUPMACDT-UHFFFAOYSA-N
Compound name
dimethylsulfamic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

2240
Patents

125.01466 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.02194 119.7
[M+Na]+ 148.00388 128.0
[M-H]- 124.00738 120.8
[M+NH4]+ 143.04848 142.0
[M+K]+ 163.97782 128.4
[M+H-H2O]+ 108.01192 115.3
[M+HCOO]- 170.01286 138.6
[M+CH3COO]- 184.02851 169.1
[M+Na-2H]- 145.98933 125.0
[M]+ 125.01411 122.4
[M]- 125.01521 122.4
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