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1,2-Benzenediol, o-(3-bromobenzoyl)-o'-(5-bromovaleryl)-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(3-bromobenzoyl)-o'-(5-bromovaleryl)-
SpectraBase Compound ID JAEDhTj520n
InChI InChI=1S/C18H16Br2O4/c19-11-4-3-10-17(21)23-15-8-1-2-9-16(15)24-18(22)13-6-5-7-14(20)12-13/h1-2,5-9,12H,3-4,10-11H2
InChIKey BEOPWBPNZHJTSY-UHFFFAOYSA-N
Mol Weight 456.13 g/mol
Molecular Formula C18H16Br2O4
Exact Mass 453.941535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qUBkEfp7q3
Name 1,2-Benzenediol, o-(3-bromobenzoyl)-o'-(5-bromovaleryl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.941534991 u
Formula C18H16Br2O4
InChI InChI=1S/C18H16Br2O4/c19-11-4-3-10-17(21)23-15-8-1-2-9-16(15)24-18(22)13-6-5-7-14(20)12-13/h1-2,5-9,12H,3-4,10-11H2
InChIKey BEOPWBPNZHJTSY-UHFFFAOYSA-N
Molecular Weight 456.130 g/mol
SMILES C(CCCC(OC=1C(=CC=CC1)OC(=O)C1=CC=CC(=C1)Br)=O)Br