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TRANS-[3-(13)-C,(14)-C]-CINNAMIC-ACID-N-ACETYL-CYSTEAMINE-THIOESTER
SpectraBase Compound ID 3S11eL9bM5j
InChI InChI=1S/C13H15NO2S/c1-11(15)14-9-10-17-13(16)8-7-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,14,15)/b8-7+/i7+1
InChIKey UFDKNYAHUYGCIC-WRFSBCFPSA-N
Mol Weight 250.32 g/mol
Molecular Formula C1213CH15NO2S
Exact Mass 250.085705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BW2iBFPSvyC
Name TRANS-[3-(13)-C,(14)-C]-CINNAMIC-ACID-N-ACETYL-CYSTEAMINE-THIOESTER
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15NO2S
InChI InChI=1S/C13H15NO2S/c1-11(15)14-9-10-17-13(16)8-7-12-5-3-2-4-6-12/h2-8H,9-10H2,1H3,(H,14,15)/b8-7+/i7+1
InChIKey UFDKNYAHUYGCIC-WRFSBCFPSA-N
Literature Reference Author J.A.BJORKLUND,E.LEETE
Literature Reference Citation PHYTOCHEM.,31,3883(1992)
Literature Reference DOI 10.1016/S0031-9422(00)97546-0
Molecular Weight 249.328 g/mol
Solvent CDCl3
Source File Reference UWMS28225