CID 57416843

3-ethenyl-5-fluoropyridine

Structural Information

Molecular Formula
C7H6FN
SMILES
C=CC1=CC(=CN=C1)F
InChI
InChI=1S/C7H6FN/c1-2-6-3-7(8)5-9-4-6/h2-5H,1H2
InChIKey
BRZOWWLQQFFSLC-UHFFFAOYSA-N
Compound name
3-ethenyl-5-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

123.04842 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.05570 119.4
[M+Na]+ 146.03764 129.0
[M-H]- 122.04114 120.8
[M+NH4]+ 141.08224 140.7
[M+K]+ 162.01158 126.6
[M+H-H2O]+ 106.04568 112.8
[M+HCOO]- 168.04662 142.5
[M+CH3COO]- 182.06227 170.9
[M+Na-2H]- 144.02309 127.7
[M]+ 123.04787 117.7
[M]- 123.04897 117.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe