CID 126970853

5-benzyl-4h,5h,6h,7h-pyrazolo[1,5-a]pyrazin-2-amine

Structural Information

Molecular Formula
C13H16N4
SMILES
C1CN2C(=CC(=N2)N)CN1CC3=CC=CC=C3
InChI
InChI=1S/C13H16N4/c14-13-8-12-10-16(6-7-17(12)15-13)9-11-4-2-1-3-5-11/h1-5,8H,6-7,9-10H2,(H2,14,15)
InChIKey
JNCRDCCWEWLFSB-UHFFFAOYSA-N
Compound name
5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1375 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.14478 152.1
[M+Na]+ 251.12672 164.9
[M+NH4]+ 246.17132 160.6
[M+K]+ 267.10066 159.4
[M-H]- 227.13022 155.7
[M+Na-2H]- 249.11217 159.3
[M]+ 228.13695 154.8
[M]- 228.13805 154.8
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.