CID 57415857

3-methyl-1h-pyrazolo[4,3-b]pyrazine

Structural Information

Molecular Formula
C6H6N4
SMILES
CC1=C2C(=NN1)N=CC=N2
InChI
InChI=1S/C6H6N4/c1-4-5-6(10-9-4)8-3-2-7-5/h2-3H,1H3,(H,8,9,10)
InChIKey
QIXKPYPWMQXIGY-UHFFFAOYSA-N
Compound name
3-methyl-2H-pyrazolo[3,4-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

134.05925 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.066526 124.3
[M+Na]+ 157.048468 136.2
[M-H]- 133.051974 123.0
[M+NH4]+ 152.093073 143.2
[M+K]+ 173.022408 132.7
[M+H-H2O]+ 117.056510 116.5
[M+HCOO]- 179.057451 145.1
[M+CH3COO]- 193.073101 138.1
[M+Na-2H]- 155.033916 134.2
[M]+ 134.05870142 124.7
[M]- 134.05979858 124.7
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