CID 84690923

3-bromo-5-methylpyrazolo[1,5-a]pyrimidin-7-amine

Structural Information

Molecular Formula
C7H7BrN4
SMILES
CC1=NC2=C(C=NN2C(=C1)N)Br
InChI
InChI=1S/C7H7BrN4/c1-4-2-6(9)12-7(11-4)5(8)3-10-12/h2-3H,9H2,1H3
InChIKey
KJEWRAXASMTPPX-UHFFFAOYSA-N
Compound name
3-bromo-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.98541 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.99269 143.2
[M+Na]+ 248.97463 147.4
[M+NH4]+ 244.01923 147.6
[M+K]+ 264.94857 148.9
[M-H]- 224.97813 143.1
[M+Na-2H]- 246.96008 146.2
[M]+ 225.98486 142.5
[M]- 225.98596 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.