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(1'R*,5S*)-5-(1'-Diphenylphosphinoylbutyl)-3-methoxycarbonylpropyl-4,5-dihydroisoxazole
SpectraBase Compound ID 2oSv3HgrJeo
InChI InChI=1S/C24H30NO4P/c1-3-11-23(22-18-19(25-29-22)12-10-17-24(26)28-2)30(27,20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-9,13-16,22-23H,3,10-12,17-18H2,1-2H3/t22-,23+/m0/s1
InChIKey ICBPHNACTKKQGO-XZOQPEGZSA-N
Mol Weight 427.48 g/mol
Molecular Formula C24H30NO4P
Exact Mass 427.191245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbkpgBhdexA
Name (1'R*,5S*)-5-(1'-Diphenylphosphinoylbutyl)-3-methoxycarbonylpropyl-4,5-dihydroisoxazole
Alternate Name(s) Methyl 4-{(5S)-5-[(1R)-1-(diphenylphosphoryl)butyl]-4,5-dihydro-3-isoxazolyl}butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30NO4P
InChI InChI=1S/C24H30NO4P/c1-3-11-23(22-18-19(25-29-22)12-10-17-24(26)28-2)30(27,20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-9,13-16,22-23H,3,10-12,17-18H2,1-2H3/t22-,23+/m0/s1
InChIKey ICBPHNACTKKQGO-XZOQPEGZSA-N
Molecular Weight 427.481 g/mol
SMILES [C@@](P(=O)(c1ccccc1)c1ccccc1)([C@]1(ON=C(C1)CCCC(=O)OC)[H])(CCC)[H]
SPLASH splash10-004i-3091000000-335819bc5ad4da0f3927
Source of Spectrum KC-1993-1443-5
Wiley ID 778222