CID 126970994

2-(azetidin-3-yl)-3-fluoropyridine dihydrochloride

Structural Information

Molecular Formula
C8H9FN2
SMILES
C1C(CN1)C2=C(C=CC=N2)F
InChI
InChI=1S/C8H9FN2/c9-7-2-1-3-11-8(7)6-4-10-5-6/h1-3,6,10H,4-5H2
InChIKey
NYNOJHRLBUVFFB-UHFFFAOYSA-N
Compound name
2-(azetidin-3-yl)-3-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.07498 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.082256 127.6
[M+Na]+ 175.064198 134.8
[M-H]- 151.067704 128.8
[M+NH4]+ 170.108803 139.0
[M+K]+ 191.038138 134.5
[M+H-H2O]+ 135.072240 114.5
[M+HCOO]- 197.073181 145.7
[M+CH3COO]- 211.088831 176.6
[M+Na-2H]- 173.049646 134.4
[M]+ 152.07443142 131.5
[M]- 152.07552858 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.