CID 165951141

3-(difluoromethyl)-5h,6h,7h,8h-imidazo[1,5-a]pyrazine

Structural Information

Molecular Formula
C7H9F2N3
SMILES
C1CN2C(=CN=C2C(F)F)CN1
InChI
InChI=1S/C7H9F2N3/c8-6(9)7-11-4-5-3-10-1-2-12(5)7/h4,6,10H,1-3H2
InChIKey
FFTKVRQOZJRATI-UHFFFAOYSA-N
Compound name
3-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

173.07645 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.083726 133.8
[M+Na]+ 196.065668 141.8
[M-H]- 172.069174 129.9
[M+NH4]+ 191.110273 152.0
[M+K]+ 212.039608 138.5
[M+H-H2O]+ 156.073710 124.5
[M+HCOO]- 218.074651 148.2
[M+CH3COO]- 232.090301 144.9
[M+Na-2H]- 194.051116 137.8
[M]+ 173.07590142 126.9
[M]- 173.07699858 126.9
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

patents stripe