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4-methyl-2-phenylsulfinyl-penta-2,3-dienoic acid methyl ester
SpectraBase Compound ID AVYjAvlDWzs
InChI InChI=1S/C13H14O3S/c1-10(2)9-12(13(14)16-3)17(15)11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey BXKCAIQUGLTGCQ-UHFFFAOYSA-N
Mol Weight 250.31 g/mol
Molecular Formula C13H14O3S
Exact Mass 250.066365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jmkTraiHYh
Name 4-methyl-2-phenylsulfinyl-penta-2,3-dienoic acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O3S
InChI InChI=1S/C13H14O3S/c1-10(2)9-12(13(14)16-3)17(15)11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey BXKCAIQUGLTGCQ-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 250.312 g/mol
Source File Reference MHKO16968