CID 15445384

N-(pyrrolidin-3-yl)benzamide hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₄N₂O

SMILES

C1CNCC1NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C11H14N2O/c14-11(9-4-2-1-3-5-9)13-10-6-7-12-8-10/h1-5,10,12H,6-8H2,(H,13,14)

InChIKey

FAVZGMWROXRERG-UHFFFAOYSA-N

Compound name

N-pyrrolidin-3-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 107
Patents: 190.11061 Da
Monoisotopic Mass: 1.0
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]+	191.11789	143.8
[M+Na]+	213.09983	153.6
[M+NH4]+	208.14443	151.9
[M+K]+	229.07377	149.5
[M-H]-	189.10333	146.6
[M+Na-2H]-	211.08528	150.2
[M]+	190.11006	145.6
[M]-	190.11116	145.6

Literature stripe

literature stripe

Patent stripe

patents stripe