CID 4340561

49773-20-8

Structural Information

Molecular Formula
C3H9NO2S
SMILES
CS(=O)(=O)CCN
InChI
InChI=1S/C3H9NO2S/c1-7(5,6)3-2-4/h2-4H2,1H3
InChIKey
SDNXQWUJWNTDCC-UHFFFAOYSA-N
Compound name
2-methylsulfonylethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

13
References

2548
Patents

123.0354 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.04268 123.9
[M+Na]+ 146.02462 132.5
[M+NH4]+ 141.06922 131.4
[M+K]+ 161.99856 126.9
[M-H]- 122.02812 122.6
[M+Na-2H]- 144.01007 126.5
[M]+ 123.03485 124.9
[M]- 123.03595 124.9
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