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9-Oxa-12-thia(5.3.3)-propellane

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9-Oxa-12-thia(5.3.3)-propellane
SpectraBase Compound ID DOEmq1q25Mu
InChI InChI=1S/C11H18OS/c1-2-4-10-6-12-7-11(10,5-3-1)9-13-8-10/h1-9H2/t10-,11+
InChIKey XBKNKDCNYRUVJB-PHIMTYICSA-N
Mol Weight 198.32 g/mol
Molecular Formula C11H18OS
Exact Mass 198.107836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7E5Rs1mBhbn
Name 9-Oxa-12-thia(5.3.3)-propellane
CAS Registry Number 50708-57-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H18OS
InChI InChI=1S/C11H18OS/c1-2-4-10-6-12-7-11(10,5-3-1)9-13-8-10/h1-9H2/t10-,11+
InChIKey XBKNKDCNYRUVJB-PHIMTYICSA-N
Instrument Name Bruker HX-90
Literature Reference K. Weinges, J. Pill, Chem. Ber. 110, 2969 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3