CID 13741013

3-chloro-4,5-dimethoxypyridazine

Structural Information

Molecular Formula

C₆H₇ClN₂O₂

SMILES

COC1=CN=NC(=C1OC)Cl

InChI

InChI=1S/C6H7ClN2O2/c1-10-4-3-8-9-6(7)5(4)11-2/h3H,1-2H3

InChIKey

AYYFMEBRLAAWOB-UHFFFAOYSA-N

Compound name

3-chloro-4,5-dimethoxypyridazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 174.0196 Da
Monoisotopic Mass: 0.7
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]+	175.02688	130.5
[M+Na]+	197.00882	145.2
[M+NH4]+	192.05342	138.6
[M+K]+	212.98276	138.9
[M-H]-	173.01232	131.4
[M+Na-2H]-	194.99427	137.9
[M]+	174.01905	133.1
[M]-	174.02015	133.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe