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3-phenylbenzothiophene 1-oxide

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3-phenylbenzothiophene 1-oxide
SpectraBase Compound ID DGENCuqcI0
InChI InChI=1S/C14H10OS/c15-16-10-13(11-6-2-1-3-7-11)12-8-4-5-9-14(12)16/h1-10H
InChIKey BKUNVUQZERKJPV-UHFFFAOYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C14H10OS
Exact Mass 226.045236 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I3iHs9dPxdu
Name 3-Phenyl-benzo(B)thiophene
CAS Registry Number 70445-87-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H10OS
InChI InChI=1S/C14H10OS/c15-16-10-13(11-6-2-1-3-7-11)12-8-4-5-9-14(12)16/h1-10H
InChIKey BKUNVUQZERKJPV-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference P. Geneste, J.L. Olive, J. Org. Chem. 44, 2887 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3