CID 3021998

92604-89-2

Structural Information

Molecular Formula
C6H8N4O2
SMILES
CC1=CC(=NNC1=O)C(=O)NN
InChI
InChI=1S/C6H8N4O2/c1-3-2-4(6(12)8-7)9-10-5(3)11/h2H,7H2,1H3,(H,8,12)(H,10,11)
InChIKey
JHJFFEANAZZBSQ-UHFFFAOYSA-N
Compound name
5-methyl-6-oxo-1H-pyridazine-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.06473 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.072006 133.2
[M+Na]+ 191.053948 142.0
[M-H]- 167.057454 133.3
[M+NH4]+ 186.098553 149.8
[M+K]+ 207.027888 139.4
[M+H-H2O]+ 151.061990 126.1
[M+HCOO]- 213.062931 155.9
[M+CH3COO]- 227.078581 179.5
[M+Na-2H]- 189.039396 139.5
[M]+ 168.06418142 130.2
[M]- 168.06527858 130.2
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.