CID 23092618

762272-45-7

Structural Information

Molecular Formula
C5H4FNS
SMILES
C1=C(C=NC=C1S)F
InChI
InChI=1S/C5H4FNS/c6-4-1-5(8)3-7-2-4/h1-3,8H
InChIKey
LJGOYNUUJSIITD-UHFFFAOYSA-N
Compound name
5-fluoropyridine-3-thiol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

129.00485 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.01213 117.3
[M+Na]+ 151.99407 127.8
[M-H]- 127.99757 119.3
[M+NH4]+ 147.03867 139.1
[M+K]+ 167.96801 125.5
[M+H-H2O]+ 112.00211 110.9
[M+HCOO]- 174.00305 135.6
[M+CH3COO]- 188.01870 169.7
[M+Na-2H]- 149.97952 122.9
[M]+ 129.00430 117.8
[M]- 129.00540 117.8
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