CID 172052400

Dihydropyrano[3,2-c]quinoline

Structural Information

Molecular Formula

C₁₂H₁₁NO

SMILES

C1CC2=C(C3=CC=CC=C3N=C2)OC1

InChI

InChI=1S/C12H11NO/c1-2-6-11-10(5-1)12-9(8-13-11)4-3-7-14-12/h1-2,5-6,8H,3-4,7H2

InChIKey

XRRRUYSJRVRKSB-UHFFFAOYSA-N

Compound name

3,4-dihydro-2H-pyrano[3,2-c]quinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 185.08406 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]+	186.091336	135.8
[M+Na]+	208.073278	143.8
[M-H]-	184.076784	140.1
[M+NH4]+	203.117883	154.9
[M+K]+	224.047218	141.4
[M+H-H2O]+	168.081320	128.4
[M+HCOO]-	230.082261	154.3
[M+CH3COO]-	244.097911	148.9
[M+Na-2H]-	206.058726	146.8
[M]+	185.08351142	134.3
[M]-	185.08460858	134.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.