CID 261892

2-phenylpyrrolidine

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CC(NC1)C2=CC=CC=C2

InChI

InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2

InChIKey

JUTDHSGANMHVIC-UHFFFAOYSA-N

Compound name

2-phenylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1828
Patents: 147.1048 Da
Monoisotopic Mass: 1.8
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]+	148.11208	132.9
[M+Na]+	170.09402	145.0
[M+NH4]+	165.13862	142.6
[M+K]+	186.06796	139.4
[M-H]-	146.09752	136.4
[M+Na-2H]-	168.07947	140.9
[M]+	147.10425	135.5
[M]-	147.10535	135.5

Literature stripe

literature stripe

Patent stripe

patents stripe