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(S)-(+)-5-Bromomellein [(S)-(+)-5-Bromo-8-hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one]
SpectraBase Compound ID 7jv3GlpHERe
InChI InChI=1S/C10H9BrO3/c1-5-4-6-7(11)2-3-8(12)9(6)10(13)14-5/h2-3,5,12H,4H2,1H3/t5-/m0/s1
InChIKey OAKDFQHJDRFNMW-YFKPBYRVSA-N
Mol Weight 257.08 g/mol
Molecular Formula C10H9BrO3
Exact Mass 255.973507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wMGuRCE90C
Name (S)-(+)-5-Bromomellein [(S)-(+)-5-Bromo-8-hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9BrO3
InChI InChI=1S/C10H9BrO3/c1-5-4-6-7(11)2-3-8(12)9(6)10(13)14-5/h2-3,5,12H,4H2,1H3/t5-/m0/s1
InChIKey OAKDFQHJDRFNMW-YFKPBYRVSA-N
Molecular Weight 257.083 g/mol
SMILES Oc1c2C(O[C@](Cc2c(Br)cc1)(C)[H])=O
SPLASH splash10-01c0-9610000000-25af75fe6ece4ed15096
Source of Spectrum K-2002-944-9
Wiley ID 1581147