CID 17039877

657391-86-1

Structural Information

Molecular Formula

C₁₁H₁₂N₂O

SMILES

CC1=CC(=C2C=CC=C(C2=N1)OC)N

InChI

InChI=1S/C11H12N2O/c1-7-6-9(12)8-4-3-5-10(14-2)11(8)13-7/h3-6H,1-2H3,(H2,12,13)

InChIKey

WFHHZADQRAEVQU-UHFFFAOYSA-N

Compound name

8-methoxy-2-methylquinolin-4-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 188.09496 Da
Monoisotopic Mass: 1.9
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]+	189.102236	139.3
[M+Na]+	211.084178	149.4
[M-H]-	187.087684	142.9
[M+NH4]+	206.128783	159.0
[M+K]+	227.058118	146.2
[M+H-H2O]+	171.092220	132.6
[M+HCOO]-	233.093161	162.5
[M+CH3COO]-	247.108811	187.1
[M+Na-2H]-	209.069626	147.0
[M]+	188.09441142	140.2
[M]-	188.09550858	140.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe