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DIBENZYL-3-[2-(METHYLSULFONYL)-PHENYLCARBAMOYL]-PROPYLPHOSPHONATE

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DIBENZYL-3-[2-(METHYLSULFONYL)-PHENYLCARBAMOYL]-PROPYLPHOSPHONATE
SpectraBase Compound ID 9ACkltEg1OC
InChI InChI=1S/C25H28NO6PS/c1-34(29,30)24-16-9-8-15-23(24)26-25(27)17-10-18-33(28,31-19-21-11-4-2-5-12-21)32-20-22-13-6-3-7-14-22/h2-9,11-16H,10,17-20H2,1H3,(H,26,27)
InChIKey HQOXGQIIJRIIFY-UHFFFAOYSA-N
Mol Weight 501.53 g/mol
Molecular Formula C25H28NO6PS
Exact Mass 501.137496 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Czt02iPttvZ
Name DIBENZYL-3-[2-(METHYLSULFONYL)-PHENYLCARBAMOYL]-PROPYLPHOSPHONATE
Compound Number 12H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28NO6PS
InChI InChI=1S/C25H28NO6PS/c1-34(29,30)24-16-9-8-15-23(24)26-25(27)17-10-18-33(28,31-19-21-11-4-2-5-12-21)32-20-22-13-6-3-7-14-22/h2-9,11-16H,10,17-20H2,1H3,(H,26,27)
InChIKey HQOXGQIIJRIIFY-UHFFFAOYSA-N
Literature Reference Author R.CHOFOR,M.D.P.RISSEEUW,J.POUYEZ,C.JOHNY,J.WOUTERS,C.S.DOWD, R.D.COUCH
Literature Reference Citation MOLECULES,19,2571(2014)
Literature Reference DOI 10.3390/molecules19022571
Molecular Weight 501.534 g/mol
Solvent CDCl3
Source File Reference UWBT14632