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]+ 176.08183 142.7
[M+Na]+ 198.06377 156.1
[M-H]- 174.06727 146.5
[M+NH4]+ 193.10837 156.5
[M+K]+ 214.03771 149.9
[M+H-H2O]+ 158.07181 134.8
[M+HCOO]- 220.07275 164.5
[M+CH3COO]- 234.08840 155.7
[M+Na-2H]- 196.04922 149.6
[M]+ 175.07400 145.4
[M]- 175.07510 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.