CID 3052583

3(2h)-pyridazinone, 2-(2-hydroxyethyl)-6-(2-methylphenoxy)-

Structural Information

Molecular Formula
C13H14N2O3
SMILES
CC1=CC=CC=C1OC2=NN(C(=O)C=C2)CCO
InChI
InChI=1S/C13H14N2O3/c1-10-4-2-3-5-11(10)18-12-6-7-13(17)15(14-12)8-9-16/h2-7,16H,8-9H2,1H3
InChIKey
JKXRIJZAXAAUGU-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethyl)-6-(2-methylphenoxy)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.10045 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.10773 154.6
[M+Na]+ 269.08967 169.5
[M+NH4]+ 264.13427 161.4
[M+K]+ 285.06361 162.9
[M-H]- 245.09317 157.0
[M+Na-2H]- 267.07512 162.9
[M]+ 246.09990 157.4
[M]- 246.10100 157.4
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.