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]+ 226.99269 135.7
[M+Na]+ 248.97463 150.4
[M-H]- 224.97813 140.2
[M+NH4]+ 244.01923 156.7
[M+K]+ 264.94857 139.1
[M+H-H2O]+ 208.98267 134.5
[M+HCOO]- 270.98361 157.9
[M+CH3COO]- 284.99926 151.6
[M+Na-2H]- 246.96008 146.5
[M]+ 225.98486 156.1
[M]- 225.98596 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.