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6,7-DIMETHYL-2-THIABICYCLO-[3.2.0]-HEPT-3-EN-6,7-DICARBONSAEURE
SpectraBase Compound ID 8hfHmZ9QtoB
InChI InChI=1S/C10H12O4S/c1-9(7(11)12)5-3-4-15-6(5)10(9,2)8(13)14/h3-6H,1-2H3,(H,11,12)(H,13,14)
InChIKey IIYFTKSEVAAFMH-UHFFFAOYSA-N
Mol Weight 228.26 g/mol
Molecular Formula C10H12O4S
Exact Mass 228.04563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FGTNjspzCJ
Name 6,7-Dimethyl-2-thia-bicyclo(3.2.0)hept-3-ene-6,7-dicarboxylic acid
CAS Registry Number 89111-18-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12O4S
InChI InChI=1S/C10H12O4S/c1-9(7(11)12)5-3-4-15-6(5)10(9,2)8(13)14/h3-6H,1-2H3,(H,11,12)(H,13,14)
InChIKey IIYFTKSEVAAFMH-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 Acetone-D6