CID 16769511

N-(prop-2-yn-1-yl)piperidine-4-carboxamide hydrochloride

Structural Information

Molecular Formula

C₉H₁₄N₂O

SMILES

C#CCNC(=O)C1CCNCC1

InChI

InChI=1S/C9H14N2O/c1-2-5-11-9(12)8-3-6-10-7-4-8/h1,8,10H,3-7H2,(H,11,12)

InChIKey

UAWZKMNSQBDMRZ-UHFFFAOYSA-N

Compound name

N-prop-2-ynylpiperidine-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 166.11061 Da
Monoisotopic Mass: -0.3
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]+	167.117886	138.2
[M+Na]+	189.099828	144.1
[M-H]-	165.103334	136.7
[M+NH4]+	184.144433	153.8
[M+K]+	205.073768	140.5
[M+H-H2O]+	149.107870	125.6
[M+HCOO]-	211.108811	150.7
[M+CH3COO]-	225.124461	185.5
[M+Na-2H]-	187.085276	141.2
[M]+	166.11006142	126.3
[M]-	166.11115858	126.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe