CID 70191

N,n-dimethylmethanesulfonamide

Structural Information

Molecular Formula
C3H9NO2S
SMILES
CN(C)S(=O)(=O)C
InChI
InChI=1S/C3H9NO2S/c1-4(2)7(3,5)6/h1-3H3
InChIKey
WCFDSGHAIGTEKL-UHFFFAOYSA-N
Compound name
N,N-dimethylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3886
Patents

123.0354 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.04268 120.3
[M+Na]+ 146.02462 128.9
[M-H]- 122.02812 122.9
[M+NH4]+ 141.06922 143.6
[M+K]+ 161.99856 129.6
[M+H-H2O]+ 106.03266 115.8
[M+HCOO]- 168.03360 140.3
[M+CH3COO]- 182.04925 172.8
[M+Na-2H]- 144.01007 125.6
[M]+ 123.03485 123.9
[M]- 123.03595 123.9
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