CID 1342

57536-86-4

Structural Information

Molecular Formula

C₁₄H₁₆N₂

SMILES

C1CN(CCN1)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C14H16N2/c1-2-6-13-12(4-1)5-3-7-14(13)16-10-8-15-9-11-16/h1-7,15H,8-11H2

InChIKey

VNICFCQJUVFULD-UHFFFAOYSA-N

Compound name

1-naphthalen-1-ylpiperazine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 67
References: 1106
Patents: 212.13135 Da
Monoisotopic Mass: 2.6
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]+	213.13863	149.7
[M+Na]+	235.12057	164.3
[M+NH4]+	230.16517	159.5
[M+K]+	251.09451	155.5
[M-H]-	211.12407	154.3
[M+Na-2H]-	233.10602	158.4
[M]+	212.13080	153.1
[M]-	212.13190	153.1

Literature stripe

literature stripe

Patent stripe

patents stripe