CID 83815861

3-fluoro-3-phenylpyrrolidine hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₂FN

SMILES

C1CNCC1(C2=CC=CC=C2)F

InChI

InChI=1S/C10H12FN/c11-10(6-7-12-8-10)9-4-2-1-3-5-9/h1-5,12H,6-8H2

InChIKey

MQXFKVRPVZNLCL-UHFFFAOYSA-N

Compound name

3-fluoro-3-phenylpyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 165.09538 Da
Monoisotopic Mass: 1.6
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]+	166.10266	136.8
[M+Na]+	188.08460	148.1
[M+NH4]+	183.12920	147.1
[M+K]+	204.05854	140.8
[M-H]-	164.08810	138.7
[M+Na-2H]-	186.07005	145.3
[M]+	165.09483	138.9
[M]-	165.09593	138.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe