CID 124364709

6-fluoropyrazolo[1,5-a]pyrimidine

Structural Information

Molecular Formula
C6H4FN3
SMILES
C1=C2N=CC(=CN2N=C1)F
InChI
InChI=1S/C6H4FN3/c7-5-3-8-6-1-2-9-10(6)4-5/h1-4H
InChIKey
BJAALDAUFFOUCO-UHFFFAOYSA-N
Compound name
6-fluoropyrazolo[1,5-a]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.03893 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.04621 120.5
[M+Na]+ 160.02815 132.8
[M-H]- 136.03165 120.6
[M+NH4]+ 155.07275 141.4
[M+K]+ 176.00209 130.0
[M+H-H2O]+ 120.03619 112.3
[M+HCOO]- 182.03713 143.2
[M+CH3COO]- 196.05278 135.3
[M+Na-2H]- 158.01360 130.6
[M]+ 137.03838 121.3
[M]- 137.03948 121.3
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.