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(1'R*,5R*)-5-(1'-Diphenylphosphinoylbutyl)-3-methoxycarbonylethyl-4,5-dihydroisoxazole
SpectraBase Compound ID BLUO5H1w8CE
InChI InChI=1S/C23H28NO4P/c1-3-10-22(21-17-18(24-28-21)15-16-23(25)27-2)29(26,19-11-6-4-7-12-19)20-13-8-5-9-14-20/h4-9,11-14,21-22H,3,10,15-17H2,1-2H3/t21-,22-/m1/s1
InChIKey WQSGUPXLXWWKAG-FGZHOGPDSA-N
Mol Weight 413.45 g/mol
Molecular Formula C23H28NO4P
Exact Mass 413.175595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D7RoE1EVKwQ
Name (1'R*,5R*)-5-(1'-Diphenylphosphinoylbutyl)-3-methoxycarbonylethyl-4,5-dihydroisoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28NO4P
InChI InChI=1S/C23H28NO4P/c1-3-10-22(21-17-18(24-28-21)15-16-23(25)27-2)29(26,19-11-6-4-7-12-19)20-13-8-5-9-14-20/h4-9,11-14,21-22H,3,10,15-17H2,1-2H3/t21-,22-/m1/s1
InChIKey WQSGUPXLXWWKAG-FGZHOGPDSA-N
Molecular Weight 413.454 g/mol
SMILES [C@@](P(=O)(c1ccccc1)c1ccccc1)([C@@]1(ON=C(C1)CCC(=O)OC)[H])(CCC)[H]
SPLASH splash10-004i-0091000000-2a3fecf6167d72b20f53
Source of Spectrum KC-1993-1442-4
Synonyms Methyl 3-{(5R)-5-[(1R)-1-(diphenylphosphoryl)butyl]-4,5-dihydro-3-isoxazolyl}propanoate
Wiley ID 778225