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2-Benzoyl-2-methyl-4H-3,1-benzoxathiine
SpectraBase Compound ID 2EqsOHtAtq7
InChI InChI=1S/C16H14O2S/c1-16(15(17)12-7-3-2-4-8-12)18-11-13-9-5-6-10-14(13)19-16/h2-10H,11H2,1H3
InChIKey GOTGWEGIMKRPDS-UHFFFAOYSA-N
Mol Weight 270.35 g/mol
Molecular Formula C16H14O2S
Exact Mass 270.071451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ISyQvsCQv4o
Name 2-BENZOYL-2-METHYL-4H-3,1-BENZOXATHIINE
CAS Registry Number 124921-65-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14O2S
InChI InChI=1S/C16H14O2S/c1-16(15(17)12-7-3-2-4-8-12)18-11-13-9-5-6-10-14(13)19-16/h2-10H,11H2,1H3
InChIKey GOTGWEGIMKRPDS-UHFFFAOYSA-N
Literature Reference Author M.SCHMIDT,H.MEIER,H.P.NIEDERMANN,R.MENGEL
Literature Reference Citation CHEM.BER.,123,1143(1990)
Literature Reference DOI 10.1002/cber.19901230530
Molecular Weight 270.346 g/mol
Solvent CDCl3
Source File Reference UWED11058