CID 65552726

1-aminopropane-2-sulfonamide hydrochloride

Structural Information

Molecular Formula
C3H10N2O2S
SMILES
CC(CN)S(=O)(=O)N
InChI
InChI=1S/C3H10N2O2S/c1-3(2-4)8(5,6)7/h3H,2,4H2,1H3,(H2,5,6,7)
InChIKey
LQVAQUHURBYBSG-UHFFFAOYSA-N
Compound name
1-aminopropane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

138.0463 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.05358 125.7
[M+Na]+ 161.03552 132.7
[M-H]- 137.03902 125.3
[M+NH4]+ 156.08012 146.5
[M+K]+ 177.00946 131.5
[M+H-H2O]+ 121.04356 120.6
[M+HCOO]- 183.04450 143.6
[M+CH3COO]- 197.06015 173.7
[M+Na-2H]- 159.02097 128.6
[M]+ 138.04575 124.3
[M]- 138.04685 124.3
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