CID 11412557

N-phenylpyrrolidin-3-amine

Structural Information

Molecular Formula

C₁₀H₁₄N₂

SMILES

C1CNCC1NC2=CC=CC=C2

InChI

InChI=1S/C10H14N2/c1-2-4-9(5-3-1)12-10-6-7-11-8-10/h1-5,10-12H,6-8H2

InChIKey

AAFUQJGCJNFFRT-UHFFFAOYSA-N

Compound name

N-phenylpyrrolidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 91
Patents: 162.11569 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]+	163.12297	136.5
[M+Na]+	185.10491	147.3
[M+NH4]+	180.14951	145.7
[M+K]+	201.07885	142.1
[M-H]-	161.10841	140.2
[M+Na-2H]-	183.09036	144.1
[M]+	162.11514	138.8
[M]-	162.11624	138.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe