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2- Mercaptoethanol ketal of (3aS*,8aR*)-6-(p-Tolylthio)-1,2,3,3a,4,5,6,7,8,8a-decahydro-3a,6-methanoazulen-5-one
SpectraBase Compound ID CMyN9S8T8Gh
InChI InChI=1S/C20H26OS2/c1-15-4-6-17(7-5-15)23-19-10-8-16-3-2-9-18(16,13-19)14-20(19)21-11-12-22-20/h4-7,16H,2-3,8-14H2,1H3
InChIKey NCCGGHOVTNKVTE-UHFFFAOYSA-N
Mol Weight 346.55 g/mol
Molecular Formula C20H26OS2
Exact Mass 346.142508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVDnZDYpVeK
Name 6-(4-Tolylthio)-5,5-ethyleneoxythio-decahydro-3a,6-methano-azulene
CAS Registry Number 64715-35-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H26OS2
InChI InChI=1S/C20H26OS2/c1-15-4-6-17(7-5-15)23-19-10-8-16-3-2-9-18(16,13-19)14-20(19)21-11-12-22-20/h4-7,16H,2-3,8-14H2,1H3
InChIKey NCCGGHOVTNKVTE-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference B.M. Trost, L.H. Latimer, J. Org. Chem. 43, 1031 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3