CID 44141773

1609406-44-1

Structural Information

Molecular Formula
C7H8N4
SMILES
C1CN2C(=CC(=N2)C#N)CN1
InChI
InChI=1S/C7H8N4/c8-4-6-3-7-5-9-1-2-11(7)10-6/h3,9H,1-2,5H2
InChIKey
RGSBNDIISLKZSJ-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

148.07489 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.08217 127.6
[M+Na]+ 171.06411 137.4
[M-H]- 147.06761 125.6
[M+NH4]+ 166.10871 144.6
[M+K]+ 187.03805 133.0
[M+H-H2O]+ 131.07215 113.0
[M+HCOO]- 193.07309 141.8
[M+CH3COO]- 207.08874 138.3
[M+Na-2H]- 169.04956 133.7
[M]+ 148.07434 118.6
[M]- 148.07544 118.6
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.