CID 69989789

2361636-37-3

Structural Information

Molecular Formula

C₈H₁₅NO₃

SMILES

COC(C1CCNCC1)C(=O)O

InChI

InChI=1S/C8H15NO3/c1-12-7(8(10)11)6-2-4-9-5-3-6/h6-7,9H,2-5H2,1H3,(H,10,11)

InChIKey

RKPIWBBFIWZFQI-UHFFFAOYSA-N

Compound name

2-methoxy-2-piperidin-4-ylacetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 173.1052 Da
Monoisotopic Mass: -2.3
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]+	174.11248	139.1
[M+Na]+	196.09442	142.6
[M-H]-	172.09792	137.5
[M+NH4]+	191.13902	156.0
[M+K]+	212.06836	141.7
[M+H-H2O]+	156.10246	133.0
[M+HCOO]-	218.10340	154.2
[M+CH3COO]-	232.11905	173.8
[M+Na-2H]-	194.07987	141.4
[M]+	173.10465	133.4
[M]-	173.10575	133.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe