CID 124707082

2490375-49-8

Structural Information

Molecular Formula
C8H9FN2
SMILES
C1C(CN1)C2=CC(=CN=C2)F
InChI
InChI=1S/C8H9FN2/c9-8-1-6(2-11-5-8)7-3-10-4-7/h1-2,5,7,10H,3-4H2
InChIKey
ILYBQKMZSZGSQF-UHFFFAOYSA-N
Compound name
3-(azetidin-3-yl)-5-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.07498 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.08226 127.6
[M+Na]+ 175.06420 134.8
[M-H]- 151.06770 128.8
[M+NH4]+ 170.10880 139.0
[M+K]+ 191.03814 134.5
[M+H-H2O]+ 135.07224 114.5
[M+HCOO]- 197.07318 145.7
[M+CH3COO]- 211.08883 176.6
[M+Na-2H]- 173.04965 134.4
[M]+ 152.07443 131.5
[M]- 152.07553 131.5
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.