CID 53273624

Ethyl 1-aminopiperidine-4-carboxylate

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CCOC(=O)C1CCN(CC1)N
InChI
InChI=1S/C8H16N2O2/c1-2-12-8(11)7-3-5-10(9)6-4-7/h7H,2-6,9H2,1H3
InChIKey
UABIHSXDHLUMBZ-UHFFFAOYSA-N
Compound name
ethyl 1-aminopiperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

172.12119 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.128466 139.0
[M+Na]+ 195.110408 143.9
[M-H]- 171.113914 140.0
[M+NH4]+ 190.155013 157.3
[M+K]+ 211.084348 143.3
[M+H-H2O]+ 155.118450 132.3
[M+HCOO]- 217.119391 158.3
[M+CH3COO]- 231.135041 180.7
[M+Na-2H]- 193.095856 142.1
[M]+ 172.12064142 134.8
[M]- 172.12173858 134.8
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