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3-(4-bromobenzoyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
SpectraBase Compound ID 3dXVJQvQaGb
InChI InChI=1S/C14H11BrO4/c15-7-3-1-6(2-4-7)12(16)10-9-8-5-18-14(19-8)13(17)11(9)10/h1-4,8-11,14H,5H2
InChIKey PGHKUIMAONOIHP-UHFFFAOYSA-N
Mol Weight 323.14 g/mol
Molecular Formula C14H11BrO4
Exact Mass 321.984072 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IEjeQtLE6rl
Name 3-(4-bromobenzoyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H11BrO4/c15-7-3-1-6(2-4-7)12(16)10-9-8-5-18-14(19-8)13(17)11(9)10/h1-4,8-11,14H,5H2
InChIKey PGHKUIMAONOIHP-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_2234
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/8221088; Labnumber: Samet; IOH_ID: IOH-002235
Temperature 297 °C