CID 86276588

1547006-95-0

Structural Information

Molecular Formula
C9H9N3O
SMILES
C1CC1C2=NN3C=CNC(=O)C3=C2
InChI
InChI=1S/C9H9N3O/c13-9-8-5-7(6-1-2-6)11-12(8)4-3-10-9/h3-6H,1-2H2,(H,10,13)
InChIKey
DVGHMPJBYNHGEA-UHFFFAOYSA-N
Compound name
2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.07455 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.081826 142.7
[M+Na]+ 198.063768 156.1
[M-H]- 174.067274 146.5
[M+NH4]+ 193.108373 156.5
[M+K]+ 214.037708 149.9
[M+H-H2O]+ 158.071810 134.8
[M+HCOO]- 220.072751 164.5
[M+CH3COO]- 234.088401 155.7
[M+Na-2H]- 196.049216 149.6
[M]+ 175.07400142 145.4
[M]- 175.07509858 145.4
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.