CID 59686798

1-methanesulfonyl-n-methylpyrrolidin-3-amine hydrochloride

Structural Information

Molecular Formula
C6H14N2O2S
SMILES
CNC1CCN(C1)S(=O)(=O)C
InChI
InChI=1S/C6H14N2O2S/c1-7-6-3-4-8(5-6)11(2,9)10/h6-7H,3-5H2,1-2H3
InChIKey
VTSUBOKMHFKQAN-UHFFFAOYSA-N
Compound name
N-methyl-1-methylsulfonylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

90
Patents

178.0776 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.084876 137.5
[M+Na]+ 201.066818 145.1
[M-H]- 177.070324 139.9
[M+NH4]+ 196.111423 158.4
[M+K]+ 217.040758 143.7
[M+H-H2O]+ 161.074860 132.0
[M+HCOO]- 223.075801 154.5
[M+CH3COO]- 237.091451 178.2
[M+Na-2H]- 199.052266 140.0
[M]+ 178.07705142 137.5
[M]- 178.07814858 137.5
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