CID 96680727

2751603-25-3

Structural Information

Molecular Formula
C4H12N2O2S
SMILES
C[C@@H](CN)S(=O)(=O)NC
InChI
InChI=1S/C4H12N2O2S/c1-4(3-5)9(7,8)6-2/h4,6H,3,5H2,1-2H3/t4-/m0/s1
InChIKey
WFSBLMWAELHOJV-BYPYZUCNSA-N
Compound name
(2S)-1-amino-N-methylpropane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.06195 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.069226 129.9
[M+Na]+ 175.051168 136.5
[M-H]- 151.054674 129.9
[M+NH4]+ 170.095773 150.4
[M+K]+ 191.025108 135.4
[M+H-H2O]+ 135.059210 124.6
[M+HCOO]- 197.060151 148.1
[M+CH3COO]- 211.075801 177.4
[M+Na-2H]- 173.036616 133.4
[M]+ 152.06140142 129.9
[M]- 152.06249858 129.9
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.