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(N-PHTHALIMIDO)-METHYL-4-(1-THIA-4-OXA-3-OXOHEXYL)-CINNAMATE
SpectraBase Compound ID GqnEONEElGj
InChI InChI=1S/C22H19NO6S/c1-2-28-20(25)13-30-16-10-7-15(8-11-16)9-12-19(24)29-14-23-21(26)17-5-3-4-6-18(17)22(23)27/h3-12H,2,13-14H2,1H3/b12-9+
InChIKey NKJLFLLOLOPWIG-FMIVXFBMSA-N
Mol Weight 425.46 g/mol
Molecular Formula C22H19NO6S
Exact Mass 425.093309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B2UiVMU1hYK
Name (N-PHTHALIMIDO)-METHYL-4-(1-THIA-4-OXA-3-OXOHEXYL)-CINNAMATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19NO6S
InChI InChI=1S/C22H19NO6S/c1-2-28-20(25)13-30-16-10-7-15(8-11-16)9-12-19(24)29-14-23-21(26)17-5-3-4-6-18(17)22(23)27/h3-12H,2,13-14H2,1H3/b12-9+
InChIKey NKJLFLLOLOPWIG-FMIVXFBMSA-N
Literature Reference Author K.EGGERS,T.M.FYLES,P.J.MONTOYA-PELAEZ
Literature Reference Citation J.ORG.CHEM.,66,2966(2001)
Literature Reference DOI 10.1021/jo0056848
Molecular Weight 425.456 g/mol
Solvent CDCl3
Source File Reference UWVN26255