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4-Methyl-5-(N-methyl-2-thioxo-2,3-dihydro-benzoxazol-6-yl)-1,2-dithiole-3-thione
SpectraBase Compound ID CySPm3OjO98
InChI InChI=1S/C12H9NOS4/c1-6-10(17-18-11(6)15)7-3-4-8-9(5-7)14-12(16)13(8)2/h3-5H,1-2H3
InChIKey KHMIJVHFGOCTGV-UHFFFAOYSA-N
Mol Weight 311.5 g/mol
Molecular Formula C12H9NOS4
Exact Mass 310.956699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68YwpB9Bern
Name 4-Methyl-5-(N-methyl-2-thioxo-2,3-dihydro-benzoxazol-6-yl)-1,2-dithiole-3-thione
CAS Registry Number 108643-45-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H9NOS4
InChI InChI=1S/C12H9NOS4/c1-6-10(17-18-11(6)15)7-3-4-8-9(5-7)14-12(16)13(8)2/h3-5H,1-2H3
InChIKey KHMIJVHFGOCTGV-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference C. Vaccher, P. Berthelot, M. Debaert, Magn. Res. Chem. 27, 498 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6