CID 5987

Sulfamic acid

Structural Information

Molecular Formula
H3NO3S
SMILES
NS(=O)(=O)O
InChI
InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)
InChIKey
IIACRCGMVDHOTQ-UHFFFAOYSA-N
Compound name
sulfamic acid
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

401
References

110545
Patents

96.98337 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 97.990646 111.8
[M+Na]+ 119.97259 120.8
[M-H]- 95.976094 111.1
[M+NH4]+ 115.01719 134.2
[M+K]+ 135.94653 119.8
[M+H-H2O]+ 79.980630 107.9
[M+HCOO]- 141.98157 130.2
[M+CH3COO]- 155.99722 158.9
[M+Na-2H]- 117.95804 117.6
[M]+ 96.982821 111.3
[M]- 96.983919 111.3
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