CID 13413093

Dimethyl piperidine-2,5-dicarboxylate

Structural Information

Molecular Formula

C₉H₁₅NO₄

SMILES

COC(=O)C1CCC(NC1)C(=O)OC

InChI

InChI=1S/C9H15NO4/c1-13-8(11)6-3-4-7(10-5-6)9(12)14-2/h6-7,10H,3-5H2,1-2H3

InChIKey

SGOAVLHEGKCEHK-UHFFFAOYSA-N

Compound name

dimethyl piperidine-2,5-dicarboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 201.10011 Da
Monoisotopic Mass: 0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	202.10739	144.6
[M+Na]+	224.08933	152.9
[M+NH4]+	219.13393	150.4
[M+K]+	240.06327	149.7
[M-H]-	200.09283	143.1
[M+Na-2H]-	222.07478	146.5
[M]+	201.09956	144.8
[M]-	201.10066	144.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe