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SINHARIN;(E)-3-(METHYLTHIO)-PROPENOIC-ACID-PHENETHYLAMIDE
SpectraBase Compound ID KrJhzuwE6I0
InChI InChI=1S/C12H15NOS/c1-15-10-8-12(14)13-9-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H,13,14)/b10-8+
InChIKey INUPOERVCMJSKS-CSKARUKUSA-N
Mol Weight 221.32 g/mol
Molecular Formula C12H15NOS
Exact Mass 221.087435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HpokfjkZyxo
Name SINHARIN;(E)-3-(METHYLTHIO)-PROPENOIC-ACID-PHENETHYLAMIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15NOS
InChI InChI=1S/C12H15NOS/c1-15-10-8-12(14)13-9-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H,13,14)/b10-8+
InChIKey INUPOERVCMJSKS-CSKARUKUSA-N
Literature Reference Author S.HINTERBERGER,O.HOFER,H.GREGER
Literature Reference Citation TETRAHEDRON,50,6279(1994)
Literature Reference DOI 10.1016/S0040-4020(01)80647-5
Molecular Weight 221.317 g/mol
Solvent CDCl3
Source File Reference UWCS21004