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5'-METHYL-5-[4-(3-METHYL-1-OXOBUTOXY)-1-BUTYNYL]-2,2'-BITHIOPHENE
SpectraBase Compound ID ACQUqUyGTtZ
InChI InChI=1S/C18H20O2S2/c1-13(2)12-18(19)20-11-5-4-6-15-8-10-17(22-15)16-9-7-14(3)21-16/h7-10,13H,5,11-12H2,1-3H3
InChIKey LJTSHVOWUZSNFP-UHFFFAOYSA-N
Mol Weight 332.48 g/mol
Molecular Formula C18H20O2S2
Exact Mass 332.090472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IlLZfMAJRU9
Name 5'-METHYL-5-[4-(3-METHYL-1-OXOBUTOXY)-1-BUTYNYL]-2,2'-BITHIOPHENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O2S2
InChI InChI=1S/C18H20O2S2/c1-13(2)12-18(19)20-11-5-4-6-15-8-10-17(22-15)16-9-7-14(3)21-16/h7-10,13H,5,11-12H2,1-3H3
InChIKey LJTSHVOWUZSNFP-UHFFFAOYSA-N
Literature Reference Author V.U.AHMAD,N.ALAM
Literature Reference Citation J.NAT.PROD.,58,1426(1995)
Literature Reference DOI 10.1021/np50123a014
Molecular Weight 332.476 g/mol
Solvent CDCl3
Source File Reference UWCS23230