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2-(2,4-DICHLOROPHENYL)-5H-4,1,3-BENZOXATHIAZEPIN-5-ONE
SpectraBase Compound ID 62ne9HMkI2v
InChI InChI=1S/C14H7Cl2NO2S/c15-8-5-6-9(11(16)7-8)13-17-19-14(18)10-3-1-2-4-12(10)20-13/h1-7H
InChIKey HCQFBMIPNKWPFJ-UHFFFAOYSA-N
Mol Weight 324.18 g/mol
Molecular Formula C14H7Cl2NO2S
Exact Mass 322.957455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1sCwNmM9f05
Name 2-(2,4-DICHLOROPHENYL)-5H-4,1,3-BENZOXATHIAZEPIN-5-ONE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H7Cl2NO2S
InChI InChI=1S/C14H7Cl2NO2S/c15-8-5-6-9(11(16)7-8)13-17-19-14(18)10-3-1-2-4-12(10)20-13/h1-7H
InChIKey HCQFBMIPNKWPFJ-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 324.181 g/mol
Solvent CDCl3
Source File Reference UWCP7694