CID 216767

37673-63-5

Structural Information

Molecular Formula

C₁₀H₁₇NO₂

SMILES

CN1CCCC(C1)C(=O)OCC=C

InChI

InChI=1S/C10H17NO2/c1-3-7-13-10(12)9-5-4-6-11(2)8-9/h3,9H,1,4-8H2,2H3

InChIKey

SLDVTJPPUYOXGD-UHFFFAOYSA-N

Compound name

prop-2-enyl 1-methylpiperidine-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 183.12593 Da
Monoisotopic Mass: 1.3
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]+	184.13321	142.1
[M+Na]+	206.11515	147.2
[M-H]-	182.11865	143.3
[M+NH4]+	201.15975	160.5
[M+K]+	222.08909	146.0
[M+H-H2O]+	166.12319	135.5
[M+HCOO]-	228.12413	160.5
[M+CH3COO]-	242.13978	181.7
[M+Na-2H]-	204.10060	144.9
[M]+	183.12538	139.7
[M]-	183.12648	139.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.