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E-3-(4'-(4,5,6,7-TETRAHYDROBENZO-[B]-THIENYL))-ETHYL-PROPENOATE
SpectraBase Compound ID BYKiQb3q3XJ
InChI InChI=1S/C13H16O2S/c1-2-15-13(14)7-6-10-4-3-5-12-11(10)8-9-16-12/h6-10H,2-5H2,1H3/b7-6+
InChIKey PMXCXOWUTWZLJW-VOTSOKGWSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ky597wkHEmX
Name E-3-(4'-(4,5,6,7-TETRAHYDROBENZO-[B]-THIENYL))-ETHYL-PROPENOATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-2-15-13(14)7-6-10-4-3-5-12-11(10)8-9-16-12/h6-10H,2-5H2,1H3/b7-6+
InChIKey PMXCXOWUTWZLJW-VOTSOKGWSA-N
Literature Reference Author P.D.CLARK,N.M.IRVINE,P.SARKAR
Literature Reference Citation CAN.J.CHEM.,69,1011(1991)
Literature Reference DOI 10.1139/v91-148
Molecular Weight 236.329 g/mol
Solvent CDCl3
Source File Reference UWTS2591