CID 6410564

Brn 0891074

Structural Information

Molecular Formula
C9H10N8
SMILES
CC1=NN(C(=C1C#N)N)C2=NN=C(C=C2)NN
InChI
InChI=1S/C9H10N8/c1-5-6(4-10)9(11)17(16-5)8-3-2-7(13-12)14-15-8/h2-3H,11-12H2,1H3,(H,13,14)
InChIKey
MTBITUFRBVIBHL-UHFFFAOYSA-N
Compound name
5-amino-1-(6-hydrazinylpyridazin-3-yl)-3-methylpyrazole-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

230.10284 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.11012 149.7
[M+Na]+ 253.09206 159.5
[M-H]- 229.09556 149.5
[M+NH4]+ 248.13666 160.7
[M+K]+ 269.06600 156.0
[M+H-H2O]+ 213.10010 132.6
[M+HCOO]- 275.10104 168.3
[M+CH3COO]- 289.11669 159.0
[M+Na-2H]- 251.07751 153.4
[M]+ 230.10229 141.6
[M]- 230.10339 141.6
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

patents stripe