CID 197785

Fenpiprane

Structural Information

Molecular Formula

C₂₀H₂₅N

SMILES

C1CCN(CC1)CCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N/c1-4-10-18(11-5-1)20(19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21/h1-2,4-7,10-13,20H,3,8-9,14-17H2

InChIKey

JXJPYHDHJZJWRI-UHFFFAOYSA-N

Compound name

1-(3,3-diphenylpropyl)piperidine

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 11
References: 768
Patents: 279.1987 Da
Monoisotopic Mass: 4.9
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]+	280.205976	169.1
[M+Na]+	302.187918	170.9
[M-H]-	278.191424	175.1
[M+NH4]+	297.232523	182.2
[M+K]+	318.161858	165.6
[M+H-H2O]+	262.195960	158.7
[M+HCOO]-	324.196901	186.0
[M+CH3COO]-	338.212551	178.0
[M+Na-2H]-	300.173366	172.1
[M]+	279.19815142	162.9
[M]-	279.19924858	162.9

Literature stripe

literature stripe

Patent stripe

patents stripe