CID 82755160

Methyl (2s)-2-methylpiperazine-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H14N2O2
SMILES
C[C@H]1CNCCN1C(=O)OC
InChI
InChI=1S/C7H14N2O2/c1-6-5-8-3-4-9(6)7(10)11-2/h6,8H,3-5H2,1-2H3/t6-/m0/s1
InChIKey
FFGQNQREEKKFSL-LURJTMIESA-N
Compound name
methyl (2S)-2-methylpiperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

158.10553 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.112806 135.8
[M+Na]+ 181.094748 141.7
[M-H]- 157.098254 134.8
[M+NH4]+ 176.139353 153.4
[M+K]+ 197.068688 140.8
[M+H-H2O]+ 141.102790 129.1
[M+HCOO]- 203.103731 152.2
[M+CH3COO]- 217.119381 172.9
[M+Na-2H]- 179.080196 139.6
[M]+ 158.10498142 131.6
[M]- 158.10607858 131.6
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.