CID 136028797

2613381-80-7

Structural Information

Molecular Formula
C6H9N5
SMILES
CC1=NN(C2=NNC(=C12)N)C
InChI
InChI=1S/C6H9N5/c1-3-4-5(7)8-9-6(4)11(2)10-3/h1-2H3,(H3,7,8,9)
InChIKey
JDJBPZXPGDWTAU-UHFFFAOYSA-N
Compound name
4,6-dimethyl-2H-pyrazolo[3,4-c]pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.0858 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.093076 130.2
[M+Na]+ 174.075018 142.8
[M-H]- 150.078524 129.6
[M+NH4]+ 169.119623 150.3
[M+K]+ 190.048958 139.5
[M+H-H2O]+ 134.083060 123.0
[M+HCOO]- 196.084001 152.3
[M+CH3COO]- 210.099651 144.1
[M+Na-2H]- 172.060466 135.4
[M]+ 151.08525142 130.6
[M]- 151.08634858 130.6
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

No patent data available for this compound.