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1-Phenylthio-1H-cyclobuta(de)naphthalene

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1-Phenylthio-1H-cyclobuta(de)naphthalene
SpectraBase Compound ID E2HqWwHUYS3
InChI InChI=1S/C17H12S/c1-2-8-13(9-3-1)18-17-14-10-4-6-12-7-5-11-15(17)16(12)14/h1-11,17H
InChIKey WNOQXRXOSPANBD-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C17H12S
Exact Mass 248.065972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DvyJTjQ9kmo
Name 1-Phenylthio-1H-cyclobuta(de)naphthalene
CAS Registry Number 85924-90-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H12S
InChI InChI=1S/C17H12S/c1-2-8-13(9-3-1)18-17-14-10-4-6-12-7-5-11-15(17)16(12)14/h1-11,17H
InChIKey WNOQXRXOSPANBD-UHFFFAOYSA-N
Literature Reference P.J. Card, F.E. Friedli, H. Shechter, J. Am. Chem. Soc. 105, 6104 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3