CID 24265150

614746-07-5

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

C1CNCCC1CN2C=CC=C2

InChI

InChI=1S/C10H16N2/c1-2-8-12(7-1)9-10-3-5-11-6-4-10/h1-2,7-8,10-11H,3-6,9H2

InChIKey

KDKCBSOKQNGPLP-UHFFFAOYSA-N

Compound name

4-(pyrrol-1-ylmethyl)piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 164.13135 Da
Monoisotopic Mass: 0.9
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]+	165.13863	138.8
[M+Na]+	187.12057	149.8
[M+NH4]+	182.16517	147.6
[M+K]+	203.09451	144.6
[M-H]-	163.12407	141.3
[M+Na-2H]-	185.10602	145.4
[M]+	164.13080	140.9
[M]-	164.13190	140.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe