CID 6401378

1-methyl-1h-pyrazolo[3,4-d]pyridazin-4-amine

Structural Information

Molecular Formula
C6H7N5
SMILES
CN1C2=CN=NC(=C2C=N1)N
InChI
InChI=1S/C6H7N5/c1-11-5-3-8-10-6(7)4(5)2-9-11/h2-3H,1H3,(H2,7,10)
InChIKey
MUWYQFOVWMBJDF-UHFFFAOYSA-N
Compound name
1-methylpyrazolo[3,4-d]pyridazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

149.07014 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.077416 128.1
[M+Na]+ 172.059358 140.5
[M-H]- 148.062864 128.2
[M+NH4]+ 167.103963 146.9
[M+K]+ 188.033298 137.3
[M+H-H2O]+ 132.067400 120.0
[M+HCOO]- 194.068341 150.9
[M+CH3COO]- 208.083991 142.2
[M+Na-2H]- 170.044806 137.3
[M]+ 149.06959142 129.2
[M]- 149.07068858 129.2
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