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3'-bromo-2',4'-dihydroxy-5'-nitrohexanophenone

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3'-bromo-2',4'-dihydroxy-5'-nitrohexanophenone
SpectraBase Compound ID 6jTBqO1gbyE
InChI InChI=1S/C12H14BrNO5/c1-2-3-4-5-9(15)7-6-8(14(18)19)12(17)10(13)11(7)16/h6,16-17H,2-5H2,1H3
InChIKey GPESIAIFJWBLBQ-UHFFFAOYSA-N
Mol Weight 332.15 g/mol
Molecular Formula C12H14BrNO5
Exact Mass 331.005536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HGxJgvSivdY
Name 3'-BROMO-2',4'-DIHYDROXY-5'-NITROHEXANOPHENONE
Source of Sample A. Cascaval, "Al. I. CUZA" University of Iassy, Iasi, Romania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14BrNO5
InChI InChI=1S/C12H14BrNO5/c1-2-3-4-5-9(15)7-6-8(14(18)19)12(17)10(13)11(7)16/h6,16-17H,2-5H2,1H3
InChIKey GPESIAIFJWBLBQ-UHFFFAOYSA-N
Melting Point 128-129C
Molecular Weight 332.16
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms HEXANOPHENONE, 3'-BROMO-2',4'-DIHYDROXY-5'-NITRO-,