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ETHYL-4-(3-METHOXYPHENYL)-4-(PATA-TOLYLOXYTHIOCARBONYLOXY)-BUTANOATE
SpectraBase Compound ID Kks6d0eM1AP
InChI InChI=1S/C21H24O5S/c1-4-24-20(22)13-12-19(16-6-5-7-18(14-16)23-3)26-21(27)25-17-10-8-15(2)9-11-17/h5-11,14,19H,4,12-13H2,1-3H3
InChIKey SWEJBEDICDLYDV-UHFFFAOYSA-N
Mol Weight 388.48 g/mol
Molecular Formula C21H24O5S
Exact Mass 388.134445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JemYbK8ri50
Name ETHYL-4-(3-METHOXYPHENYL)-4-(PATA-TOLYLOXYTHIOCARBONYLOXY)-BUTANOATE
Compound Number VIII
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O5S
InChI InChI=1S/C21H24O5S/c1-4-24-20(22)13-12-19(16-6-5-7-18(14-16)23-3)26-21(27)25-17-10-8-15(2)9-11-17/h5-11,14,19H,4,12-13H2,1-3H3
InChIKey SWEJBEDICDLYDV-UHFFFAOYSA-N
Literature Reference Author N.M.FRIEDEMANN,A.HAERTER,S.BRANDES,S.GROB,D.GERLACH,W.MUENCH ,D.SCHOLLMEYER,U.NUB
Literature Reference Citation EUR.J.ORG.CHEM.,2012,2346(2012)
Literature Reference DOI 10.1002/ejoc.201200073
Molecular Weight 388.479 g/mol
Solvent CDCl3
Source File Reference UWLU85173