CID 1383265

3-phenylpyrrolidine

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CNC[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C10H13N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h1-5,10-11H,6-8H2/t10-/m0/s1

InChIKey

PRRFFTYUBPGHLE-JTQLQIEISA-N

Compound name

(3R)-3-phenylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 1821
Patents: 147.1048 Da
Monoisotopic Mass: 1.7
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

No literature data available for this compound.

Patent stripe

patents stripe