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6,7-DIMETHYL-2-THIABICYCLO-[3.2.0]-HEPT-3-EN-6,7-DICARBONSAEUREMETHYLESTER
SpectraBase Compound ID GS4QlHzfHXj
InChI InChI=1S/C12H16O4S/c1-11(9(13)15-3)7-5-6-17-8(7)12(11,2)10(14)16-4/h5-8H,1-4H3
InChIKey PHAGYOUOQKYZMY-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Scj2lZViCu
Name 6,7-Dimethyl-2-thia-bicyclo(3.2.0)hept-3-ene-6,7-dicarboxylic acid, dimethyl ester
CAS Registry Number 89111-19-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-11(9(13)15-3)7-5-6-17-8(7)12(11,2)10(14)16-4/h5-8H,1-4H3
InChIKey PHAGYOUOQKYZMY-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference V. Leon, R.A. Bolivar, M.L. Tasayco, Org. Magn. Resonance 21, 470 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3