CID 293600

5,6-dimethyl-1h-pyrazolo[3,4-b]pyrazin-3-amine

Structural Information

Molecular Formula
C7H9N5
SMILES
CC1=NC2=C(NN=C2N=C1C)N
InChI
InChI=1S/C7H9N5/c1-3-4(2)10-7-5(9-3)6(8)11-12-7/h1-2H3,(H3,8,10,11,12)
InChIKey
PACRXBIRSBYZHI-UHFFFAOYSA-N
Compound name
5,6-dimethyl-2H-pyrazolo[3,4-b]pyrazin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

163.0858 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.093076 134.1
[M+Na]+ 186.075018 146.6
[M-H]- 162.078524 133.1
[M+NH4]+ 181.119623 152.0
[M+K]+ 202.048958 142.3
[M+H-H2O]+ 146.083060 126.5
[M+HCOO]- 208.084001 155.1
[M+CH3COO]- 222.099651 147.4
[M+Na-2H]- 184.060466 141.5
[M]+ 163.08525142 134.1
[M]- 163.08634858 134.1
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.