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4-BROMO-5-HYDROXY-3-(1-HYDROXYBUTYL)-5-METHYL-2-(5H)-FURANONE;BROMOBECKERELIDE
SpectraBase Compound ID IWRT3OJIJuK
InChI InChI=1S/C9H13BrO4/c1-3-4-5(11)6-7(10)9(2,13)14-8(6)12/h5,11,13H,3-4H2,1-2H3
InChIKey AOOHYYJGKJWREN-UHFFFAOYSA-N
Mol Weight 265.1 g/mol
Molecular Formula C9H13BrO4
Exact Mass 263.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRY0H4B3CrH
Name 4-Bromanyl-5-methyl-5-oxidanyl-3-(1-oxidanylbutyl)furan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13BrO4
InChI InChI=1S/C9H13BrO4/c1-3-4-5(11)6-7(10)9(2,13)14-8(6)12/h5,11,13H,3-4H2,1-2H3
InChIKey AOOHYYJGKJWREN-UHFFFAOYSA-N
Molecular Weight 265.103 g/mol
SMILES OC1(OC(C(C(O)CCC)=C1Br)=O)C
SPLASH splash10-0006-9010000000-17d59f010621e92e1072
Source of Spectrum J-60-1821-2
Synonyms 4-Bromo-5-hydroxy-3-(1-hydroxybutyl)-5-methyl-2-furanone 4-Bromo-5-hydroxy-3-(1-hydroxybutyl)-5-methyl-furan-2-one
Wiley ID 1267358