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]+ 150.07742 128.1
[M+Na]+ 172.05936 140.5
[M-H]- 148.06286 128.2
[M+NH4]+ 167.10396 146.9
[M+K]+ 188.03330 137.3
[M+H-H2O]+ 132.06740 120.0
[M+HCOO]- 194.06834 150.9
[M+CH3COO]- 208.08399 142.2
[M+Na-2H]- 170.04481 137.3
[M]+ 149.06959 129.2
[M]- 149.07069 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