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3-Benzoyl-4-phenyl-thiet-2-one
SpectraBase Compound ID OTVNeAqOzy
InChI InChI=1S/C16H10O2S/c17-14(11-7-3-1-4-8-11)13-15(19-16(13)18)12-9-5-2-6-10-12/h1-10H
InChIKey WRVZGKOVXXZDQI-UHFFFAOYSA-N
Mol Weight 266.31 g/mol
Molecular Formula C16H10O2S
Exact Mass 266.040151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbqFiO2Sq8s
Name 3-Benzoyl-4-phenyl-thiet-2-one
CAS Registry Number 85601-42-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H10O2S
InChI InChI=1S/C16H10O2S/c17-14(11-7-3-1-4-8-11)13-15(19-16(13)18)12-9-5-2-6-10-12/h1-10H
InChIKey WRVZGKOVXXZDQI-UHFFFAOYSA-N
Instrument Name Bruker WH-400
Literature Reference C. Wentrup, H.W. Winter, G. Gross, Angew. Chem. 96, 791 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3