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]+ 277.11828 161.0
[M+Na]+ 299.10022 169.8
[M-H]- 275.10372 164.1
[M+NH4]+ 294.14482 173.8
[M+K]+ 315.07416 166.4
[M+H-H2O]+ 259.10826 151.8
[M+HCOO]- 321.10920 182.1
[M+CH3COO]- 335.12485 195.9
[M+Na-2H]- 297.08567 166.5
[M]+ 276.11045 165.3
[M]- 276.11155 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.