CID 165657732

3-bromo-n-methylpyrazolo[1,5-a]pyrazin-4-amine

Structural Information

Molecular Formula
C7H7BrN4
SMILES
CNC1=NC=CN2C1=C(C=N2)Br
InChI
InChI=1S/C7H7BrN4/c1-9-7-6-5(8)4-11-12(6)3-2-10-7/h2-4H,1H3,(H,9,10)
InChIKey
DQRNRZXSYUMKPM-UHFFFAOYSA-N
Compound name
3-bromo-N-methylpyrazolo[1,5-a]pyrazin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.98541 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.992686 135.7
[M+Na]+ 248.974628 150.4
[M-H]- 224.978134 140.2
[M+NH4]+ 244.019233 156.7
[M+K]+ 264.948568 139.1
[M+H-H2O]+ 208.982670 134.5
[M+HCOO]- 270.983611 157.9
[M+CH3COO]- 284.999261 151.6
[M+Na-2H]- 246.960076 146.5
[M]+ 225.98486142 156.1
[M]- 225.98595858 156.1
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.