CID 72219243

3-chloro-6-cyclopropoxypyridazine

Structural Information

Molecular Formula

C₇H₇ClN₂O

SMILES

C1CC1OC2=NN=C(C=C2)Cl

InChI

InChI=1S/C7H7ClN2O/c8-6-3-4-7(10-9-6)11-5-1-2-5/h3-5H,1-2H2

InChIKey

JYQMAYFDEITSPE-UHFFFAOYSA-N

Compound name

3-chloro-6-cyclopropyloxypyridazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 170.02469 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]+	171.03197	135.7
[M+Na]+	193.01391	147.1
[M-H]-	169.01741	140.4
[M+NH4]+	188.05851	149.5
[M+K]+	208.98785	143.0
[M+H-H2O]+	153.02195	128.0
[M+HCOO]-	215.02289	154.5
[M+CH3COO]-	229.03854	148.9
[M+Na-2H]-	190.99936	143.6
[M]+	170.02414	140.1
[M]-	170.02524	140.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.