CID 74892841

1373223-49-4

Structural Information

Molecular Formula

C₉H₁₀ClNO

SMILES

C1CC(C2=NC=CC(=C2C1)Cl)O

InChI

InChI=1S/C9H10ClNO/c10-7-4-5-11-9-6(7)2-1-3-8(9)12/h4-5,8,12H,1-3H2

InChIKey

OYDHRDQQGNQCPY-UHFFFAOYSA-N

Compound name

4-chloro-5,6,7,8-tetrahydroquinolin-8-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 183.04509 Da
Monoisotopic Mass: 1.4
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]+	184.052366	134.9
[M+Na]+	206.034308	144.0
[M-H]-	182.037814	136.6
[M+NH4]+	201.078913	155.0
[M+K]+	222.008248	139.4
[M+H-H2O]+	166.042350	129.6
[M+HCOO]-	228.043291	149.3
[M+CH3COO]-	242.058941	147.7
[M+Na-2H]-	204.019756	142.1
[M]+	183.04454142	133.6
[M]-	183.04563858	133.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe