CID 28707509

N-(2-aminoethyl)-n-methylmethanesulfonamide hydrochloride

Structural Information

Molecular Formula
C4H12N2O2S
SMILES
CN(CCN)S(=O)(=O)C
InChI
InChI=1S/C4H12N2O2S/c1-6(4-3-5)9(2,7)8/h3-5H2,1-2H3
InChIKey
XHZATVSDPWJIKI-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-N-methylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

152.06195 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06923 129.5
[M+Na]+ 175.05117 136.6
[M-H]- 151.05467 131.0
[M+NH4]+ 170.09577 150.8
[M+K]+ 191.02511 136.4
[M+H-H2O]+ 135.05921 124.1
[M+HCOO]- 197.06015 149.3
[M+CH3COO]- 211.07580 180.0
[M+Na-2H]- 173.03662 133.5
[M]+ 152.06140 131.4
[M]- 152.06250 131.4
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