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(1R,3R,4S)-7-bromo-4-hydroxy-1,3-dimethyl-3,4-dihydro-1H-isochromene-5,8-quinone
SpectraBase Compound ID 8ZzRfOY1mD9
InChI InChI=1S/C11H11BrO4/c1-4-8-9(10(14)5(2)16-4)7(13)3-6(12)11(8)15/h3-5,10,14H,1-2H3/t4-,5-,10-/m1/s1
InChIKey UHNHALVUORBGBR-FJNYAOGASA-N
Mol Weight 287.11 g/mol
Molecular Formula C11H11BrO4
Exact Mass 285.984072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2g5jHr06fA
Name (1R,3R,4S)-7-Bromo-3,4-dihydro-4-hydroxy-1,3-dimethylbenzo[c]pyran-5,8-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11BrO4
InChI InChI=1S/C11H11BrO4/c1-4-8-9(10(14)5(2)16-4)7(13)3-6(12)11(8)15/h3-5,10,14H,1-2H3/t4-,5-,10-/m1/s1
InChIKey UHNHALVUORBGBR-FJNYAOGASA-N
Molecular Weight 287.109 g/mol
SMILES O[C@]1(C2=C(C(C(=CC2=O)Br)=O)[C@](O[C@@]1(C)[H])(C)[H])[H]
SPLASH splash10-0006-0190000000-d62025f850cb82768011
Source of Spectrum F5-3-271-12
Synonyms (1R,3R,4S)-7-bromo-4-hydroxy-1,3-dimethyl-3,4-dihydro-1H-isochromene-5,8-dione (1R,3R,4S)-7-bromo-4-hydroxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-5,8-dione (1R,3R,4S)-7-bromanyl-1,3-dimethyl-4-oxidanyl-3,4-dihydro-1H-isochromene-5,8-dione
Wiley ID 1732145