CID 165944368

3-(methanesulfonylmethyl)-3-methylpyrrolidine hydrochloride

Structural Information

Molecular Formula
C7H15NO2S
SMILES
CC1(CCNC1)CS(=O)(=O)C
InChI
InChI=1S/C7H15NO2S/c1-7(3-4-8-5-7)6-11(2,9)10/h8H,3-6H2,1-2H3
InChIKey
ZWIRUXAXECIGDO-UHFFFAOYSA-N
Compound name
3-methyl-3-(methylsulfonylmethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.08235 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08963 138.2
[M+Na]+ 200.07157 145.8
[M-H]- 176.07507 139.0
[M+NH4]+ 195.11617 160.6
[M+K]+ 216.04551 143.8
[M+H-H2O]+ 160.07961 134.1
[M+HCOO]- 222.08055 152.5
[M+CH3COO]- 236.09620 172.2
[M+Na-2H]- 198.05702 141.4
[M]+ 177.08180 137.5
[M]- 177.08290 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

No patent data available for this compound.