CID 10750137

338949-36-3

Structural Information

Molecular Formula

C₁₂H₁₆N₂

SMILES

C1CCN2C(C1)CNC3=CC=CC=C32

InChI

InChI=1S/C12H16N2/c1-2-7-12-11(6-1)13-9-10-5-3-4-8-14(10)12/h1-2,6-7,10,13H,3-5,8-9H2

InChIKey

YNWGNIXGOYARFJ-UHFFFAOYSA-N

Compound name

6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxaline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 188.13135 Da
Monoisotopic Mass: 2.7
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]+	189.13863	141.4
[M+Na]+	211.12057	146.8
[M-H]-	187.12407	141.3
[M+NH4]+	206.16517	159.3
[M+K]+	227.09451	142.0
[M+H-H2O]+	171.12861	133.3
[M+HCOO]-	233.12955	154.7
[M+CH3COO]-	247.14520	151.7
[M+Na-2H]-	209.10602	149.1
[M]+	188.13080	133.6
[M]-	188.13190	133.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe