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(+)-P-2-(S)-[2-CYANOETHOXY-(N-HEYL)-PHOSPHINOTHIOYLOXY]-PENTANEDIOIC-ACID-DIMETHYLESTER
SpectraBase Compound ID JgVIrUCMECL
InChI InChI=1S/C16H28NO6PS/c1-4-5-6-7-13-24(25,22-12-8-11-17)23-14(16(19)21-3)9-10-15(18)20-2/h14H,4-10,12-13H2,1-3H3/t14-,24?/m1/s1
InChIKey OIVOQTVMNBLRIL-GMBBYQRISA-N
Mol Weight 393.43 g/mol
Molecular Formula C16H28NO6PS
Exact Mass 393.137496 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0tW7bOu6Kt
Name (+)-P-2-(S)-[2-CYANOETHOXY-(N-HEYL)-PHOSPHINOTHIOYLOXY]-PENTANEDIOIC-ACID-DIMETHYLESTER
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28NO6PS
InChI InChI=1S/C16H28NO6PS/c1-4-5-6-7-13-24(25,22-12-8-11-17)23-14(16(19)21-3)9-10-15(18)20-2/h14H,4-10,12-13H2,1-3H3/t14-,24?/m1/s1
InChIKey OIVOQTVMNBLRIL-GMBBYQRISA-N
Literature Reference Author H.LU,C.E.BERKMAN
Literature Reference Citation BIOORG.MED.CHEM.,9,395(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00254-6
Molecular Weight 393.435 g/mol
Solvent CDCl3
Source File Reference UWLU21761