SpectraBase Spectrum ID |
6kqoFzzxCIv |
Name |
2-Amino-5-cyano-6-(4'-fluorophenyl)-4-methylsulfanyl-4H-pyran-3-ylphosphonic acid diethyl ester tetrafluoroborate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H19BF5N2O4PS |
InChI |
InChI=1S/C17H19FN2O4PS.BF4/c1-4-22-25(21,23-5-2)15-16(26-3)13(10-19)14(24-17(15)20)11-6-8-12(18)9-7-11;2-1(3,4)5/h6-9H,4-5,20H2,1-3H3;/q+1;-1 |
InChIKey |
INKJFDOCSIUFBI-UHFFFAOYSA-N |
Molecular Weight |
484.185 g/mol |
SMILES |
[B-](F)(F)(F)F.Nc1[o+]c(-c2ccc(F)cc2)c(c(c1P(=O)(OCC)OCC)SC)C#N |
SPLASH |
splash10-00dj-8709000000-c26d5e6954eff3487b65 |
Source of Spectrum |
H1-48-719-3 |
Synonyms |
Diethyl 2-amino-5-cyano-6-(4-fluorophenyl)-4-(methylsulfanyl)-3-pyryliumylphosphonate tetrafluoroborate |
Wiley ID |
816345 |