CID 55276477

951626-38-3

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1CN2C(=CC=N2)C(=O)N1
InChI
InChI=1S/C6H7N3O/c10-6-5-1-2-8-9(5)4-3-7-6/h1-2H,3-4H2,(H,7,10)
InChIKey
GLQXAHBYDJPCHG-UHFFFAOYSA-N
Compound name
6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

214
Patents

137.05891 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.06619 127.0
[M+Na]+ 160.04813 138.3
[M+NH4]+ 155.09273 134.8
[M+K]+ 176.02207 134.8
[M-H]- 136.05163 126.5
[M+Na-2H]- 158.03358 131.4
[M]+ 137.05836 128.1
[M]- 137.05946 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe