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E-5-Diphenylphosphinoyl-6-methyl-7-triphenylmethoxyhept-2-en-4-one diasterisomer
SpectraBase Compound ID FEiYSXE2qfU
InChI InChI=1S/C39H37O3P/c1-3-19-37(40)38(43(41,35-26-15-7-16-27-35)36-28-17-8-18-29-36)31(2)30-42-39(32-20-9-4-10-21-32,33-22-11-5-12-23-33)34-24-13-6-14-25-34/h3-29,31,38H,30H2,1-2H3/b19-3+/t31-,38-/m0/s1
InChIKey RIYVZBDAYYGXMU-DKURTLKHSA-N
Mol Weight 584.7 g/mol
Molecular Formula C39H37O3P
Exact Mass 584.248032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzqDP39eWcB
Name E-5-Diphenylphosphinoyl-6-methyl-7-triphenylmethoxyhept-2-en-4-one diasterisomer
Alternate Name(s) (2E)-5-(diphenylphosphoryl)-6-methyl-7-(trityloxy)-2-hepten-4-one (E,5S,6S)-5-diphenylphosphoryl-6-methyl-7-(triphenylmethyl)oxy-2-hepten-4-one (E,5S,6S)-5-diphenylphosphoryl-6-methyl-7-trityloxyhept-2-en-4-one (E,5S,6S)-5-diphenylphosphoryl-6-methyl-7-(triphenylmethyl)oxy-hept-2-en-4-one
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Formula C39H37O3P
InChI InChI=1S/C39H37O3P/c1-3-19-37(40)38(43(41,35-26-15-7-16-27-35)36-28-17-8-18-29-36)31(2)30-42-39(32-20-9-4-10-21-32,33-22-11-5-12-23-33)34-24-13-6-14-25-34/h3-29,31,38H,30H2,1-2H3/b19-3+/t31-,38-/m0/s1
InChIKey RIYVZBDAYYGXMU-DKURTLKHSA-N
Molecular Weight 584.696 g/mol
SMILES [C@](P(=O)(c1ccccc1)c1ccccc1)(C(\C=C\C)=O)([C@](COC(c1ccccc1)(c1ccccc1)c1ccccc1)(C)[H])[H]
SPLASH splash10-0006-0079000000-b88743f510eebc8fa939
Source of Spectrum KC-1993-522-4
Wiley ID 779110