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(2S)-2-diphenylphosphoryl-2-fluoro-1-phenyl-2-(3-thienyl)ethanone
SpectraBase Compound ID 1OrfoJJ82kv
InChI InChI=1S/C24H18FO2PS/c25-24(20-16-17-29-18-20,23(26)19-10-4-1-5-11-19)28(27,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-18H/t24-/m0/s1
InChIKey FVGWPLPAVDYWAN-DEOSSOPVSA-N
Mol Weight 420.44 g/mol
Molecular Formula C24H18FO2PS
Exact Mass 420.074916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sFW190399U
Name (2S)-2-diphenylphosphoryl-2-fluoro-1-phenyl-2-(3-thienyl)ethanone
Appearance White solid
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Formula C24H18FO2PS
InChI InChI=1S/C24H18FO2PS/c25-24(20-16-17-29-18-20,23(26)19-10-4-1-5-11-19)28(27,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-18H/t24-/m0/s1
InChIKey FVGWPLPAVDYWAN-DEOSSOPVSA-N
Ionization Type EI
Molecular Weight 420.438 g/mol
Optical Rotation [a]D26.3 = 177 (c = 0.5, CHCl3)
Reported Formula C24H18FO2PS
SMILES [C@@](P(c1ccccc1)(c1ccccc1)=O)(F)(c1cscc1)C(c1ccccc1)=O
SPLASH splash10-0zfr-2690300000-7dce2336653a4736c268
Sample Comments 95% ee
Source of Spectrum CN112142791A
Wiley ID 1877210