CID 112573871

[methyl(prop-2-yn-1-yl)sulfamoyl]amine

Structural Information

Molecular Formula
C4H8N2O2S
SMILES
CN(CC#C)S(=O)(=O)N
InChI
InChI=1S/C4H8N2O2S/c1-3-4-6(2)9(5,7)8/h1H,4H2,2H3,(H2,5,7,8)
InChIKey
FOTMRTTZFPFFHJ-UHFFFAOYSA-N
Compound name
3-[methyl(sulfamoyl)amino]prop-1-yne
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

148.03065 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.03793 135.0
[M+Na]+ 171.01987 144.2
[M-H]- 147.02337 136.3
[M+NH4]+ 166.06447 154.1
[M+K]+ 186.99381 144.1
[M+H-H2O]+ 131.02791 123.8
[M+HCOO]- 193.02885 149.3
[M+CH3COO]- 207.04450 186.8
[M+Na-2H]- 169.00532 137.8
[M]+ 148.03010 130.9
[M]- 148.03120 130.9
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.