CID 138039479

2202413-45-2

Structural Information

Molecular Formula

C₁₀H₁₉NO₃

SMILES

CN1CCC(CC1)(CCOC)C(=O)O

InChI

InChI=1S/C10H19NO3/c1-11-6-3-10(4-7-11,9(12)13)5-8-14-2/h3-8H2,1-2H3,(H,12,13)

InChIKey

QVPJYXUWINVLGH-UHFFFAOYSA-N

Compound name

4-(2-methoxyethyl)-1-methylpiperidine-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 201.13649 Da
Monoisotopic Mass: -2.0
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]+	202.14377	146.9
[M+Na]+	224.12571	155.9
[M+NH4]+	219.17031	155.0
[M+K]+	240.09965	149.6
[M-H]-	200.12921	146.4
[M+Na-2H]-	222.11116	151.1
[M]+	201.13594	147.9
[M]-	201.13704	147.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe