CID 3044671

4-piperidinecarboxylic acid, 4-amino-, pentyl ester, ethanedioate (1:2)

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CCCCCOC(=O)C1(CCNCC1)N
InChI
InChI=1S/C11H22N2O2/c1-2-3-4-9-15-10(14)11(12)5-7-13-8-6-11/h13H,2-9,12H2,1H3
InChIKey
TYXBSZYVESTCNX-UHFFFAOYSA-N
Compound name
pentyl 4-aminopiperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.16812 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.17540 152.5
[M+Na]+ 237.15734 159.8
[M+NH4]+ 232.20194 160.2
[M+K]+ 253.13128 153.0
[M-H]- 213.16084 152.4
[M+Na-2H]- 235.14279 156.3
[M]+ 214.16757 153.1
[M]- 214.16867 153.1
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.