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(S)-(+)-5,7-Dibromomellein [(S)-(+)-5,7-Dibromo-8-hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one]
SpectraBase Compound ID HfeNX9CS6L2
InChI InChI=1S/C10H8Br2O3/c1-4-2-5-6(11)3-7(12)9(13)8(5)10(14)15-4/h3-4,13H,2H2,1H3/t4-/m0/s1
InChIKey HQEVKOQSLJASJB-BYPYZUCNSA-N
Mol Weight 335.98 g/mol
Molecular Formula C10H8Br2O3
Exact Mass 333.88402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gtma7MoKzKq
Name (S)-(+)-5,7-Dibromomellein [(S)-(+)-5,7-Dibromo-8-hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8Br2O3
InChI InChI=1S/C10H8Br2O3/c1-4-2-5-6(11)3-7(12)9(13)8(5)10(14)15-4/h3-4,13H,2H2,1H3/t4-/m0/s1
InChIKey HQEVKOQSLJASJB-BYPYZUCNSA-N
Molecular Weight 335.979 g/mol
SMILES Oc1c2C(O[C@](Cc2c(Br)cc1Br)(C)[H])=O
SPLASH splash10-00kr-1009000000-05891322fb076e5756f2
Source of Spectrum K-2002-944-10
Wiley ID 1581146