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2-Amino-5-cyano-3-(diethoxy-phosphoryl)-4-methylsulfanyl-6-phenyl-pyranylium tetrafluoroborate

View entire compound with spectra: 1 MS (GC)

2-Amino-5-cyano-3-(diethoxy-phosphoryl)-4-methylsulfanyl-6-phenyl-pyranylium tetrafluoroborate
SpectraBase Compound ID CoLq9MFBhNa
InChI InChI=1S/C17H20N2O4PS.BF4/c1-4-21-24(20,22-5-2)15-16(25-3)13(11-18)14(23-17(15)19)12-9-7-6-8-10-12;2-1(3,4)5/h6-10H,4-5,19H2,1-3H3;/q+1;-1
InChIKey OZRSXCDEQWPPFT-UHFFFAOYSA-N
Mol Weight 466.19 g/mol
Molecular Formula C17H20BF4N2O4PS
Exact Mass 466.091058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtTXWCRUrFM
Name 2-Amino-5-cyano-3-(diethoxy-phosphoryl)-4-methylsulfanyl-6-phenyl-pyranylium tetrafluoroborate
Alternate Name(s) 2-Amino-5-cyano-6-phenyl-4-methylsulfanyl-4H-pyran-3-ylphosphonic acid diethyl ester tetrafluoroborate Diethyl 2-amino-5-cyano-4-(methylsulfanyl)-6-phenyl-3-pyryliumylphosphonate tetrafluoroborate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20BF4N2O4PS
InChI InChI=1S/C17H20N2O4PS.BF4/c1-4-21-24(20,22-5-2)15-16(25-3)13(11-18)14(23-17(15)19)12-9-7-6-8-10-12;2-1(3,4)5/h6-10H,4-5,19H2,1-3H3;/q+1;-1
InChIKey OZRSXCDEQWPPFT-UHFFFAOYSA-N
Molecular Weight 466.194 g/mol
SMILES [B-](F)(F)(F)F.Nc1[o+]c(-c2ccccc2)c(c(c1P(=O)(OCC)OCC)SC)C#N
SPLASH splash10-056r-9834000000-3d2dc16f60caf72f9bd1
Source of Spectrum H1-48-718-3
Wiley ID 816346