CID 66617741

(2s)-1-methanesulfonyl-2-methylpiperazine hydrochloride

Structural Information

Molecular Formula
C6H14N2O2S
SMILES
C[C@H]1CNCCN1S(=O)(=O)C
InChI
InChI=1S/C6H14N2O2S/c1-6-5-7-3-4-8(6)11(2,9)10/h6-7H,3-5H2,1-2H3/t6-/m0/s1
InChIKey
PSZFGHUEAYIHLB-LURJTMIESA-N
Compound name
(2S)-2-methyl-1-methylsulfonylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

89
Patents

178.0776 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.08488 137.7
[M+Na]+ 201.06682 144.8
[M-H]- 177.07032 137.0
[M+NH4]+ 196.11142 155.0
[M+K]+ 217.04076 142.3
[M+H-H2O]+ 161.07486 131.8
[M+HCOO]- 223.07580 148.8
[M+CH3COO]- 237.09145 173.9
[M+Na-2H]- 199.05227 140.5
[M]+ 178.07705 134.9
[M]- 178.07815 134.9
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