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3,7-Dimethyl-1H,9H,10H-thiopyrano(3,2-C:5,6-C')dipyran-1,9-dione
SpectraBase Compound ID JLAOwWcyTxR
InChI InChI=1S/C13H10O4S/c1-6-3-10-8(12(14)16-6)5-9-11(18-10)4-7(2)17-13(9)15/h3-4H,5H2,1-2H3
InChIKey AQOIEOQYVLVEBN-UHFFFAOYSA-N
Mol Weight 262.28 g/mol
Molecular Formula C13H10O4S
Exact Mass 262.02998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIIYiLPbTrP
Name 3,7-Dimethyl-1H,9H,10H-thiopyrano(3,2-C:5,6-C')dipyran-1,9-dione
CAS Registry Number 101560-45-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H10O4S
InChI InChI=1S/C13H10O4S/c1-6-3-10-8(12(14)16-6)5-9-11(18-10)4-7(2)17-13(9)15/h3-4H,5H2,1-2H3
InChIKey AQOIEOQYVLVEBN-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference M. Moreno-Manas, J. Ribas, A. Virgili, Magn. Res. Chem. 25, 985 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3