CID 145746

Ethyl sulfamate

Structural Information

Molecular Formula
C2H7NO3S
SMILES
CCOS(=O)(=O)N
InChI
InChI=1S/C2H7NO3S/c1-2-6-7(3,4)5/h2H2,1H3,(H2,3,4,5)
InChIKey
BGGQCYYULFFRLC-UHFFFAOYSA-N
Compound name
ethyl sulfamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

550
Patents

125.01466 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.02194 120.1
[M+Na]+ 148.00388 128.7
[M-H]- 124.00738 120.6
[M+NH4]+ 143.04848 142.2
[M+K]+ 163.97782 128.2
[M+H-H2O]+ 108.01192 115.6
[M+HCOO]- 170.01286 139.4
[M+CH3COO]- 184.02851 167.6
[M+Na-2H]- 145.98933 125.5
[M]+ 125.01411 122.3
[M]- 125.01521 122.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.