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3-(3-BrOMOM-4-METHOXYPHENYL)-5,6-DIHYDRO-7H-1,4,2-OXATHIAZEPIN-7-ONE
SpectraBase Compound ID I68qquBCwDw
InChI InChI=1S/C11H10BrNO3S/c1-15-9-3-2-7(6-8(9)12)11-13-16-10(14)4-5-17-11/h2-3,6H,4-5H2,1H3
InChIKey HRHWLWBWGMACKX-UHFFFAOYSA-N
Mol Weight 316.17 g/mol
Molecular Formula C11H10BrNO3S
Exact Mass 314.956477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9GIj2kDImcD
Name 3-(3-BrOMOM-4-METHOXYPHENYL)-5,6-DIHYDRO-7H-1,4,2-OXATHIAZEPIN-7-ONE
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10BrNO3S
InChI InChI=1S/C11H10BrNO3S/c1-15-9-3-2-7(6-8(9)12)11-13-16-10(14)4-5-17-11/h2-3,6H,4-5H2,1H3
InChIKey HRHWLWBWGMACKX-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 316.169 g/mol
Solvent CDCl3
Source File Reference UWCP7688