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5,7-Bis(ethylthio)-2,1,3-cyclohepta(C)thiadiazol-6-one
SpectraBase Compound ID Gpbg4bySaG7
InChI InChI=1S/C11H12N2OS3/c1-3-15-9-5-7-8(13-17-12-7)6-10(11(9)14)16-4-2/h5-6H,3-4H2,1-2H3
InChIKey DCMRADLBJPUYAG-UHFFFAOYSA-N
Mol Weight 284.41 g/mol
Molecular Formula C11H12N2OS3
Exact Mass 284.011177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Yk87rJUxg9
Name 5,7-Bis(ethylthio)-2,1,3-cyclohepta(C)thiadiazol-6-one
CAS Registry Number 85122-42-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12N2OS3
InChI InChI=1S/C11H12N2OS3/c1-3-15-9-5-7-8(13-17-12-7)6-10(11(9)14)16-4-2/h5-6H,3-4H2,1-2H3
InChIKey DCMRADLBJPUYAG-UHFFFAOYSA-N
Literature Reference G. Seitz, H.S. The, Chemiker-Zeitung 106, 411 (1982).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3