CID 5725722

N'-[(e)-(2,5-dimethoxyphenyl)methylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide

Structural Information

Molecular Formula
C14H14N4O4
SMILES
COC1=CC(=C(C=C1)OC)/C=N/NC(=O)C2=NNC(=O)C=C2
InChI
InChI=1S/C14H14N4O4/c1-21-10-3-5-12(22-2)9(7-10)8-15-18-14(20)11-4-6-13(19)17-16-11/h3-8H,1-2H3,(H,17,19)(H,18,20)/b15-8+
InChIKey
NNXXJUKCUXSZRL-OVCLIPMQSA-N
Compound name
N-[(E)-(2,5-dimethoxyphenyl)methylideneamino]-6-oxo-1H-pyridazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

302.1015 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.108776 166.5
[M+Na]+ 325.090718 174.3
[M-H]- 301.094224 171.2
[M+NH4]+ 320.135323 178.0
[M+K]+ 341.064658 171.0
[M+H-H2O]+ 285.098760 156.5
[M+HCOO]- 347.099701 190.6
[M+CH3COO]- 361.115351 206.7
[M+Na-2H]- 323.076166 172.4
[M]+ 302.10095142 169.0
[M]- 302.10204858 169.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.