CID 137964738

(s-aminosulfonimidoyl)dimethylamine hydrochloride

Structural Information

Molecular Formula
C2H9N3OS
SMILES
CN(C)S(=N)(=O)N
InChI
InChI=1S/C2H9N3OS/c1-5(2)7(3,4)6/h1-2H3,(H3,3,4,6)
InChIKey
SURABMWEBVLDIS-UHFFFAOYSA-N
Compound name
N-(aminosulfonimidoyl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

123.04663 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.053906 121.1
[M+Na]+ 146.035848 128.3
[M-H]- 122.039354 122.9
[M+NH4]+ 141.080453 143.2
[M+K]+ 162.009788 128.0
[M+H-H2O]+ 106.043890 115.7
[M+HCOO]- 168.044831 142.2
[M+CH3COO]- 182.060481 176.9
[M+Na-2H]- 144.021296 126.3
[M]+ 123.04608142 120.0
[M]- 123.04717858 120.0
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