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5'-METHYL-[5-(3-HYDROXY-4-ISOVALEROXY-1-BUTYNYL)]-2,2'-BITHIOPHENE
SpectraBase Compound ID 3dLYrX9bt1t
InChI InChI=1S/C18H20O3S2/c1-12(2)10-18(20)21-11-14(19)5-6-15-7-9-17(23-15)16-8-4-13(3)22-16/h4,7-9,12,14,19H,10-11H2,1-3H3
InChIKey LCZVNCUYRRCVRZ-UHFFFAOYSA-N
Mol Weight 348.48 g/mol
Molecular Formula C18H20O3S2
Exact Mass 348.085387 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 32Rujw9xlbK
Name 5'-METHYL-[5-(3-HYDROXY-4-ISOVALEROXY-1-BUTYNYL)]-2,2'-BITHIOPHENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O3S2
InChI InChI=1S/C18H20O3S2/c1-12(2)10-18(20)21-11-14(19)5-6-15-7-9-17(23-15)16-8-4-13(3)22-16/h4,7-9,12,14,19H,10-11H2,1-3H3
InChIKey LCZVNCUYRRCVRZ-UHFFFAOYSA-N
Literature Reference Author V.U.AHMAD,N.ALAM
Literature Reference Citation PHYTOCHEM.,42,733(1996)
Literature Reference DOI 10.1016/0031-9422(96)89777-9
Molecular Weight 348.475 g/mol
Solvent CDCl3
Source File Reference UWLU3558