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(1S/R,2S/R,4S)-4-Benzyloxy-1,4-diphenyl-2-diphenylphosphinoylbutan-1-ol
SpectraBase Compound ID 6y8aI9Y1CJ9
InChI InChI=1S/C35H33O3P/c36-35(30-20-10-3-11-21-30)34(39(37,31-22-12-4-13-23-31)32-24-14-5-15-25-32)26-33(29-18-8-2-9-19-29)38-27-28-16-6-1-7-17-28/h1-25,33-36H,26-27H2/t33-,34-,35-/m0/s1
InChIKey XBECFALVKIICLT-IMKBVMFZSA-N
Mol Weight 532.6 g/mol
Molecular Formula C35H33O3P
Exact Mass 532.216732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HNHg2oVYPAt
Name (1S/R,2S/R,4S)-4-Benzyloxy-1,4-diphenyl-2-diphenylphosphinoylbutan-1-ol
Alternate Name(s) (1S,2S,4S)-2-diphenylphosphoryl-1,4-diphenyl-4-phenylmethoxy-1-butanol (1S,2S,4S)-2-diphenylphosphoryl-1,4-diphenyl-4-phenylmethoxybutan-1-ol (1S,2S,4S)-4-benzyloxy-2-diphenylphosphoryl-1,4-diphenyl-butan-1-ol (1S,2S,4S)-2-diphenylphosphoryl-1,4-diphenyl-4-phenylmethoxy-butan-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C35H33O3P
InChI InChI=1S/C35H33O3P/c36-35(30-20-10-3-11-21-30)34(39(37,31-22-12-4-13-23-31)32-24-14-5-15-25-32)26-33(29-18-8-2-9-19-29)38-27-28-16-6-1-7-17-28/h1-25,33-36H,26-27H2/t33-,34-,35-/m0/s1
InChIKey XBECFALVKIICLT-IMKBVMFZSA-N
Molecular Weight 532.620 g/mol
SMILES O[C@]([C@@](P(=O)(c1ccccc1)c1ccccc1)(C[C@](OCc1ccccc1)(c1ccccc1)[H])[H])(c1ccccc1)[H]
SPLASH splash10-004i-0090040000-0ce9d3696d98aa993873
Source of Spectrum KC-0-1980-37
Wiley ID 828506