CID 853680

Methyl piperidine-2-carboxylate

Structural Information

Molecular Formula
C7H13NO2
SMILES
COC(=O)[C@@H]1CCCCN1
InChI
InChI=1S/C7H13NO2/c1-10-7(9)6-4-2-3-5-8-6/h6,8H,2-5H2,1H3/t6-/m0/s1
InChIKey
CXQTTWVBUDFUNO-LURJTMIESA-N
Compound name
methyl (2S)-piperidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1195
Patents

143.09464 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 131.4
[M+Na]+ 166.08386 141.0
[M+NH4]+ 161.12846 139.1
[M+K]+ 182.05780 136.2
[M-H]- 142.08736 131.5
[M+Na-2H]- 164.06931 135.5
[M]+ 143.09409 132.4
[M]- 143.09519 132.4
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