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2-PHENYL-5H-4,1,3-BENZOXATHIAZEPIN-5-ONE

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2-PHENYL-5H-4,1,3-BENZOXATHIAZEPIN-5-ONE
SpectraBase Compound ID 3VZhu2DpMZV
InChI InChI=1S/C14H9NO2S/c16-14-11-8-4-5-9-12(11)18-13(15-17-14)10-6-2-1-3-7-10/h1-9H
InChIKey URFVOCCODJWESB-UHFFFAOYSA-N
Mol Weight 255.29 g/mol
Molecular Formula C14H9NO2S
Exact Mass 255.0354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CIntmnUr81Y
Name 2-PHENYL-5H-4,1,3-BENZOXATHIAZEPIN-5-ONE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H9NO2S
InChI InChI=1S/C14H9NO2S/c16-14-11-8-4-5-9-12(11)18-13(15-17-14)10-6-2-1-3-7-10/h1-9H
InChIKey URFVOCCODJWESB-UHFFFAOYSA-N
Literature Reference Author W.JOHNSON,S.LITTLER,C.SKENE
Literature Reference Citation HETEROCYCLES,36,1471(1993)
Literature Reference DOI 10.3987/COM-93-6361
Molecular Weight 255.291 g/mol
Solvent CDCl3
Source File Reference UWCP7693