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(2Z,2'Z)-2-(1-TERT.-BUTYL-4-HYDROXY-2-METHYLBUT-2-EN-1-YLIDENE)-4-METHYL-5-PHENYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE
SpectraBase Compound ID JSC1cvNSJrW
InChI InChI=1S/C20H26O3S/c1-14(11-12-21)18(20(3,4)5)17-13-15(2)19(24(17,22)23)16-9-7-6-8-10-16/h6-11,13,19,21H,12H2,1-5H3/b14-11+,18-17+/t19-/m1/s1
InChIKey AEUCIFQVVYBQLT-ZRYQOCGTSA-N
Mol Weight 346.49 g/mol
Molecular Formula C20H26O3S
Exact Mass 346.160266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LoNZC8ncgbQ
Name (2Z,2'Z)-2-(1-TERT.-BUTYL-4-HYDROXY-2-METHYLBUT-2-EN-1-YLIDENE)-4-METHYL-5-PHENYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O3S
InChI InChI=1S/C20H26O3S/c1-14(11-12-21)18(20(3,4)5)17-13-15(2)19(24(17,22)23)16-9-7-6-8-10-16/h6-11,13,19,21H,12H2,1-5H3/b14-11+,18-17+/t19-/m1/s1
InChIKey AEUCIFQVVYBQLT-ZRYQOCGTSA-N
Literature Reference Author J.A.SOUTO,C.S.LOPEZ,O.N.FAZA,R.ALVAREZ,A.R.D.LERA
Literature Reference Citation ORG.LETTERS,7,1565(2005)
Literature Reference DOI 10.1021/ol050240p
Molecular Weight 346.485 g/mol
Sample ID 62060
Solvent CDCl3