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1-BENZOYL-6,7-DICARBOXY-7-METHYL-2-THIABICYClO-[3.2.0]-HEPT-3-ENE
SpectraBase Compound ID 9tZq8T96bNp
InChI InChI=1S/C16H14O5S/c1-15(14(20)21)11(13(18)19)10-7-8-22-16(10,15)12(17)9-5-3-2-4-6-9/h2-8,10-11H,1H3,(H,18,19)(H,20,21)
InChIKey ZCRSYZJOTVWEMO-UHFFFAOYSA-N
Mol Weight 318.34 g/mol
Molecular Formula C16H14O5S
Exact Mass 318.056195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID qrDBY0pXNq
Name 1-BENZOYL-6,7-DICARBOXY-7-METHYL-2-THIABICYClO-[3.2.0]-HEPT-3-ENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14O5S
InChI InChI=1S/C16H14O5S/c1-15(14(20)21)11(13(18)19)10-7-8-22-16(10,15)12(17)9-5-3-2-4-6-9/h2-8,10-11H,1H3,(H,18,19)(H,20,21)
InChIKey ZCRSYZJOTVWEMO-UHFFFAOYSA-N
Literature Reference Author C.RIVAS,R.A.BOLIVAR,R.GONZALEZ,R.MACHADO,F.VARGAS
Literature Reference Citation MH.CHEM.,127,529(1996)
Literature Reference DOI 10.1007/BF00807078
Molecular Weight 318.344 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ107