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2-[2'-(1''-ETHYL-1''-METHOXYPROPYL)-PYRROLIDINE-1'-YL]-4H-1,3,2-BENZODIOXAPHOSPHORIN-2-SULFIDE;MIXTURE

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2-[2'-(1''-ETHYL-1''-METHOXYPROPYL)-PYRROLIDINE-1'-YL]-4H-1,3,2-BENZODIOXAPHOSPHORIN-2-SULFIDE;MIXTURE
SpectraBase Compound ID 17SnvrWMXsZ
InChI InChI=1S/2C17H26NO3PS/c2*1-4-17(5-2,19-3)16-11-8-12-18(16)22(23)20-13-14-9-6-7-10-15(14)21-22/h2*6-7,9-10,16H,4-5,8,11-13H2,1-3H3/t2*16-,22?/m11/s1
InChIKey SVAAUOFHPMBLOT-VJIADDINSA-N
Mol Weight 710.87 g/mol
Molecular Formula C34H52N2O6P2S2
Exact Mass 710.274204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1h7B9XJQyBw
Name 2-[2'-(1''-ETHYL-1''-METHOXYPROPYL)-PYRROLIDINE-1'-YL]-4H-1,3,2-BENZODIOXAPHOSPHORIN-2-SULFIDE;MIXTURE
Compound Number 2 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H52N2O6P2S2
InChI InChI=1S/2C17H26NO3PS/c2*1-4-17(5-2,19-3)16-11-8-12-18(16)22(23)20-13-14-9-6-7-10-15(14)21-22/h2*6-7,9-10,16H,4-5,8,11-13H2,1-3H3/t2*16-,22?/m11/s1
InChIKey SVAAUOFHPMBLOT-VJIADDINSA-N
Literature Reference Author E.H.R.MORALES,C.A.ROMAN,J.O.THOMANN,C.MEIER
Literature Reference Citation EUR.J.ORG.CHEM.,2011,4397(2011)
Literature Reference DOI 10.1002/ejoc.201100334
Molecular Weight 710.864 g/mol
Solvent CDCl3
Source File Reference UWBT21096