CID 5136276

N-ethylmethanesulfonamide

Structural Information

Molecular Formula
C3H9NO2S
SMILES
CCNS(=O)(=O)C
InChI
InChI=1S/C3H9NO2S/c1-3-4-7(2,5)6/h4H,3H2,1-2H3
InChIKey
PZVFQOBASICMME-UHFFFAOYSA-N
Compound name
N-ethylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2939
Patents

123.0354 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.04268 124.0
[M+Na]+ 146.02462 133.0
[M+NH4]+ 141.06922 131.7
[M+K]+ 161.99856 127.1
[M-H]- 122.02812 123.0
[M+Na-2H]- 144.01007 127.1
[M]+ 123.03485 125.2
[M]- 123.03595 125.2
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