CID 82318

2-aminoethyl sulfamate

Structural Information

Molecular Formula
C2H8N2O3S
SMILES
C(COS(=O)(=O)N)N
InChI
InChI=1S/C2H8N2O3S/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)
InChIKey
BMIPZKURGVVSKZ-UHFFFAOYSA-N
Compound name
2-aminoethyl sulfamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

140.02556 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.03284 123.6
[M+Na]+ 163.01478 131.2
[M-H]- 139.01828 123.2
[M+NH4]+ 158.05938 144.3
[M+K]+ 178.98872 130.1
[M+H-H2O]+ 123.02282 118.4
[M+HCOO]- 185.02376 143.1
[M+CH3COO]- 199.03941 172.0
[M+Na-2H]- 161.00023 128.3
[M]+ 140.02501 123.8
[M]- 140.02611 123.8
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

patents stripe