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TRANS-3'-METHYLSULPHONYLALLYL-TRANS-CINNAMATE

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TRANS-3'-METHYLSULPHONYLALLYL-TRANS-CINNAMATE
SpectraBase Compound ID LFCowEgdj39
InChI InChI=1S/C13H14O4S/c1-18(15,16)11-5-10-17-13(14)9-8-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3/b9-8+,11-5+
InChIKey XKWYWPLJJOFUCZ-SXGHKVHISA-N
Mol Weight 266.31 g/mol
Molecular Formula C13H14O4S
Exact Mass 266.06128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4H3XJ44MaD7
Name TRANS-3'-METHYLSULPHONYLALLYL-TRANS-CINNAMATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O4S
InChI InChI=1S/C13H14O4S/c1-18(15,16)11-5-10-17-13(14)9-8-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3/b9-8+,11-5+
InChIKey XKWYWPLJJOFUCZ-SXGHKVHISA-N
Literature Reference Author O.CASTRO,J.LOPEZ,A.VERGARA,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,48,640(1985)
Literature Reference DOI 10.1021/np50040a021
Molecular Weight 266.312 g/mol
Solvent Unknown
Source File Reference UWCS3041