CID 10149033

(2-methylquinolin-4-yl)methanol

Structural Information

Molecular Formula

C₁₁H₁₁NO

SMILES

CC1=NC2=CC=CC=C2C(=C1)CO

InChI

InChI=1S/C11H11NO/c1-8-6-9(7-13)10-4-2-3-5-11(10)12-8/h2-6,13H,7H2,1H3

InChIKey

MNDWQNXETQDJMZ-UHFFFAOYSA-N

Compound name

(2-methylquinolin-4-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 165
Patents: 173.08406 Da
Monoisotopic Mass: 1.7
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]+	174.09134	135.4
[M+Na]+	196.07328	150.6
[M+NH4]+	191.11788	145.0
[M+K]+	212.04722	142.9
[M-H]-	172.07678	138.3
[M+Na-2H]-	194.05873	143.4
[M]+	173.08351	138.5
[M]-	173.08461	138.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe