CID 53256682

3-chloro-6-(tetrahydro-2h-pyran-4-yloxy)pyridazine

Structural Information

Molecular Formula
C9H11ClN2O2
SMILES
C1COCCC1OC2=NN=C(C=C2)Cl
InChI
InChI=1S/C9H11ClN2O2/c10-8-1-2-9(12-11-8)14-7-3-5-13-6-4-7/h1-2,7H,3-6H2
InChIKey
HDDUNLLTIWGKIY-UHFFFAOYSA-N
Compound name
3-chloro-6-(oxan-4-yloxy)pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.0509 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.05818 143.2
[M+Na]+ 237.04012 150.4
[M-H]- 213.04362 146.9
[M+NH4]+ 232.08472 158.1
[M+K]+ 253.01406 148.4
[M+H-H2O]+ 197.04816 134.9
[M+HCOO]- 259.04910 157.0
[M+CH3COO]- 273.06475 155.1
[M+Na-2H]- 235.02557 150.3
[M]+ 214.05035 142.9
[M]- 214.05145 142.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.