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

36
Patents

134.05925 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.06653 124.3
[M+Na]+ 157.04847 136.2
[M-H]- 133.05197 123.0
[M+NH4]+ 152.09307 143.2
[M+K]+ 173.02241 132.7
[M+H-H2O]+ 117.05651 116.5
[M+HCOO]- 179.05745 145.1
[M+CH3COO]- 193.07310 138.1
[M+Na-2H]- 155.03392 134.2
[M]+ 134.05870 124.7
[M]- 134.05980 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