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VYBFILXLBMWOLI-UHFFFAOYSA-N

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VYBFILXLBMWOLI-UHFFFAOYSA-N
SpectraBase Compound ID 3uj5K3R6ZwC
InChI InChI=1S/C12H7Br3O/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H
InChIKey VYBFILXLBMWOLI-UHFFFAOYSA-N
Mol Weight 406.9 g/mol
Molecular Formula C12H7Br3O
Exact Mass 403.804704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HgecETzgRBx
Name VYBFILXLBMWOLI-UHFFFAOYSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H7Br3O
InChI InChI=1S/C12H7Br3O/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H
InChIKey VYBFILXLBMWOLI-UHFFFAOYSA-N
Literature Reference Author J.HU,E.KOLEHMAINEN,J.KNUUTINEN
Literature Reference Citation MAGN.RES.CHEM.,38,375(2000)
Literature Reference DOI 10.1002/1097-458x(200005)38:5<375::aid-mrc629>3.0.co;2-n
Molecular Weight 406.899 g/mol
Solvent CDCl3
Source File Reference UWBS1401