CID 14343567

2-(6-chloro-pyridazin-3-yloxy)-ethanol

Structural Information

Molecular Formula

C₆H₇ClN₂O₂

SMILES

C1=CC(=NN=C1OCCO)Cl

InChI

InChI=1S/C6H7ClN2O2/c7-5-1-2-6(9-8-5)11-4-3-10/h1-2,10H,3-4H2

InChIKey

PVUHELHFJISBLS-UHFFFAOYSA-N

Compound name

2-(6-chloropyridazin-3-yl)oxyethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 174.0196 Da
Monoisotopic Mass: 0.2
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]+	175.02688	131.2
[M+Na]+	197.00882	145.0
[M+NH4]+	192.05342	139.0
[M+K]+	212.98276	138.8
[M-H]-	173.01232	131.5
[M+Na-2H]-	194.99427	138.2
[M]+	174.01905	133.4
[M]-	174.02015	133.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe