CID 13382920

3-pyridazinecarboxylic acid, 6-(4-morpholinyl)-, (3-ethoxy-1-methyl-3-oxopropylidene)hydrazide

Structural Information

Molecular Formula
C15H21N5O4
SMILES
CCOC(=O)C/C(=N/NC(=O)C1=NN=C(C=C1)N2CCOCC2)/C
InChI
InChI=1S/C15H21N5O4/c1-3-24-14(21)10-11(2)16-19-15(22)12-4-5-13(18-17-12)20-6-8-23-9-7-20/h4-5H,3,6-10H2,1-2H3,(H,19,22)/b16-11+
InChIKey
JDJOEAODUYRTPS-LFIBNONCSA-N
Compound name
ethyl (3E)-3-[(6-morpholin-4-ylpyridazine-3-carbonyl)hydrazinylidene]butanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.15936 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.16664 177.5
[M+Na]+ 358.14858 185.6
[M+NH4]+ 353.19318 180.9
[M+K]+ 374.12252 182.6
[M-H]- 334.15208 179.4
[M+Na-2H]- 356.13403 181.0
[M]+ 335.15881 178.5
[M]- 335.15991 178.5
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.