CID 165646873

2751611-23-9

Structural Information

Molecular Formula
C12H22N2O4
SMILES
CC1(CN(CCN1)C(=O)OC(C)(C)C)C(=O)OC
InChI
InChI=1S/C12H22N2O4/c1-11(2,3)18-10(16)14-7-6-13-12(4,8-14)9(15)17-5/h13H,6-8H2,1-5H3
InChIKey
ZIGKUQLSRWBOJT-UHFFFAOYSA-N
Compound name
1-O-tert-butyl 3-O-methyl 3-methylpiperazine-1,3-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.15796 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.16524 160.4
[M+Na]+ 281.14718 167.7
[M+NH4]+ 276.19178 166.0
[M+K]+ 297.12112 163.8
[M-H]- 257.15068 157.3
[M+Na-2H]- 279.13263 162.8
[M]+ 258.15741 160.2
[M]- 258.15851 160.2
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.