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(E)-3-[1'-(PHENYLTHIO)-PROP-2'-ENYL]-BUTAN-4-OLIDE
SpectraBase Compound ID 2gzAom23O8B
InChI InChI=1S/C13H14O2S/c1-2-12(10-8-13(14)15-9-10)16-11-6-4-3-5-7-11/h2-7,10,12H,1,8-9H2
InChIKey QXBJBIXXZZVZEV-UHFFFAOYSA-N
Mol Weight 234.31 g/mol
Molecular Formula C13H14O2S
Exact Mass 234.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2XQdAyeF69I
Name (E)-3-[1'-(PHENYLTHIO)-PROP-2'-ENYL]-BUTAN-4-OLIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O2S
InChI InChI=1S/C13H14O2S/c1-2-12(10-8-13(14)15-9-10)16-11-6-4-3-5-7-11/h2-7,10,12H,1,8-9H2
InChIKey QXBJBIXXZZVZEV-UHFFFAOYSA-N
Literature Reference Author R.K.HAYNES,P.A.SCHOBER,M.R.BINNS
Literature Reference Citation AUSTR.J.CHEM.,40,1223(1987)
Literature Reference DOI 10.1071/ch9871223
Molecular Weight 234.313 g/mol
Solvent Unknown
Source File Reference UWWR96