CID 3052592

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

Structural Information

Molecular Formula
C14H16N2O4
SMILES
CCOC1=CC=CC=C1OC2=NN(C(=O)C=C2)CCO
InChI
InChI=1S/C14H16N2O4/c1-2-19-11-5-3-4-6-12(11)20-13-7-8-14(18)16(15-13)9-10-17/h3-8,17H,2,9-10H2,1H3
InChIKey
DBSQPEHNZUQFAQ-UHFFFAOYSA-N
Compound name
6-(2-ethoxyphenoxy)-2-(2-hydroxyethyl)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.111 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.118276 161.0
[M+Na]+ 299.100218 169.8
[M-H]- 275.103724 164.1
[M+NH4]+ 294.144823 173.8
[M+K]+ 315.074158 166.4
[M+H-H2O]+ 259.108260 151.8
[M+HCOO]- 321.109201 182.1
[M+CH3COO]- 335.124851 195.9
[M+Na-2H]- 297.085666 166.5
[M]+ 276.11045142 165.3
[M]- 276.11154858 165.3
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.