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3-(3,4-DIMETHOXYPHENYL)-5,6-DIHYDRO-7H-1,4,2-OXATHIAZEPIN-7-ONE
SpectraBase Compound ID Gh5lafEL1Sw
InChI InChI=1S/C12H13NO4S/c1-15-9-4-3-8(7-10(9)16-2)12-13-17-11(14)5-6-18-12/h3-4,7H,5-6H2,1-2H3
InChIKey NHDQZYSBQPNOFN-UHFFFAOYSA-N
Mol Weight 267.3 g/mol
Molecular Formula C12H13NO4S
Exact Mass 267.056529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7OKJHpvHJo
Name 3-(3,4-DIMETHOXYPHENYL)-5,6-DIHYDRO-7H-1,4,2-OXATHIAZEPIN-7-ONE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO4S
InChI InChI=1S/C12H13NO4S/c1-15-9-4-3-8(7-10(9)16-2)12-13-17-11(14)5-6-18-12/h3-4,7H,5-6H2,1-2H3
InChIKey NHDQZYSBQPNOFN-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 267.300 g/mol
Solvent CDCl3
Source File Reference UWCP7687