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(4S,5R)-3-BENZYL-5-BUTYL-4-(DIPHENYLPHOSPHINOYLMETHYL)-OXAZOLIDIN-2-ONE;ANTI
SpectraBase Compound ID 1GNf3PEMk3P
InChI InChI=1S/C27H30NO3P/c1-2-3-19-26-25(28(27(29)31-26)20-22-13-7-4-8-14-22)21-32(30,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,25-26H,2-3,19-21H2,1H3/t25-,26-/m1/s1
InChIKey YOHJXTJBMDHCNO-CLJLJLNGSA-N
Mol Weight 447.51 g/mol
Molecular Formula C27H30NO3P
Exact Mass 447.196331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dtjm3oovbD4
Name (4S,5R)-3-benzyl-5-butyl-4-(diphenylphosphorylmethyl)oxazolidin-2-one
Alternate Name(s) (4S,5R)-5-butyl-4-(diphenylphosphorylmethyl)-3-(phenylmethyl)-1,3-oxazolidin-2-one (4S,5R)-5-butyl-4-(diphenylphosphorylmethyl)-3-(phenylmethyl)-2-oxazolidinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30NO3P
InChI InChI=1S/C27H30NO3P/c1-2-3-19-26-25(28(27(29)31-26)20-22-13-7-4-8-14-22)21-32(30,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,25-26H,2-3,19-21H2,1H3/t25-,26-/m1/s1
InChIKey YOHJXTJBMDHCNO-CLJLJLNGSA-N
Molecular Weight 447.515 g/mol
SMILES C1(N([C@@]([C@](O1)(CCCC)[H])(CP(=O)(c1ccccc1)c1ccccc1)[H])Cc1ccccc1)=O
SPLASH splash10-0udj-0090700000-0887af59c2268e17f9e9
Source of Spectrum KC-0-1820-49
Wiley ID 828578