CID 67620

332-23-0

Structural Information

Molecular Formula
C7H9FN
SMILES
C1=CC=[N+](C=C1)CCF
InChI
InChI=1S/C7H9FN/c8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2/q+1
InChIKey
JKJUQGLVMDQFDE-UHFFFAOYSA-N
Compound name
1-(2-fluoroethyl)pyridin-1-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

126.0719 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.07918 122.3
[M+Na]+ 149.06112 130.6
[M-H]- 125.06462 123.6
[M+NH4]+ 144.10572 142.9
[M+K]+ 165.03506 123.5
[M+H-H2O]+ 109.06916 118.1
[M+HCOO]- 171.07010 144.9
[M+CH3COO]- 185.08575 164.4
[M+Na-2H]- 147.04657 133.3
[M]+ 126.07135 119.7
[M]- 126.07245 119.7
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