CID 5321849

5,6,7,8-tetrahydro-2,4-dimethylquinoline

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

CC1=CC(=NC2=C1CCCC2)C

InChI

InChI=1S/C11H15N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h7H,3-6H2,1-2H3

InChIKey

ZBIKAJHAGKBFKR-UHFFFAOYSA-N

Compound name

2,4-dimethyl-5,6,7,8-tetrahydroquinoline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 161.12045 Da
Monoisotopic Mass: 2.8
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]+	162.12773	134.7
[M+Na]+	184.10967	149.1
[M+NH4]+	179.15427	145.2
[M+K]+	200.08361	141.0
[M-H]-	160.11317	138.3
[M+Na-2H]-	182.09512	142.0
[M]+	161.11990	137.9
[M]-	161.12100	137.9

Literature stripe

literature stripe

Patent stripe

patents stripe