CID 3052576

69024-93-7

Structural Information

Molecular Formula
C12H11ClN2O3
SMILES
C1=CC=C(C(=C1)OC2=NN(C(=O)C=C2)CCO)Cl
InChI
InChI=1S/C12H11ClN2O3/c13-9-3-1-2-4-10(9)18-11-5-6-12(17)15(14-11)7-8-16/h1-6,16H,7-8H2
InChIKey
OTJVTRMAAPTYBK-UHFFFAOYSA-N
Compound name
6-(2-chlorophenoxy)-2-(2-hydroxyethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

266.0458 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05308 155.5
[M+Na]+ 289.03502 171.4
[M+NH4]+ 284.07962 162.7
[M+K]+ 305.00896 164.1
[M-H]- 265.03852 157.9
[M+Na-2H]- 287.02047 164.1
[M]+ 266.04525 158.7
[M]- 266.04635 158.7
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

patents stripe