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5-epi-3-(1'-Acetoxybutyl)-4-bromo-5-methyl-5-methoxy-2(5H)-furanone
SpectraBase Compound ID G5VoL7I3SAm
InChI InChI=1S/C12H17BrO5/c1-5-6-8(17-7(2)14)9-10(13)12(3,16-4)18-11(9)15/h8H,5-6H2,1-4H3
InChIKey KZVSYNZEHWQHJE-UHFFFAOYSA-N
Mol Weight 321.17 g/mol
Molecular Formula C12H17BrO5
Exact Mass 320.025937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12TAkiNiLhX
Name 5-epi-3-(1'-Acetoxybutyl)-4-bromo-5-methyl-5-methoxy-2(5H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17BrO5
InChI InChI=1S/C12H17BrO5/c1-5-6-8(17-7(2)14)9-10(13)12(3,16-4)18-11(9)15/h8H,5-6H2,1-4H3
InChIKey KZVSYNZEHWQHJE-UHFFFAOYSA-N
Molecular Weight 321.167 g/mol
SMILES C=1(C(OC(C1Br)(OC)C)=O)C(OC(=O)C)CCC
SPLASH splash10-014i-0910000000-93fda5b013dc927813fa
Source of Spectrum F-49-11218-5
Synonyms 3-(1'-Acetoxybutyl)-4-bromo-5-methyl-5-methoxy-2(5H)-furanone Acetic acid 1-(4-bromo-5-methoxy-5-methyl-2-oxo-3-furanyl)butyl ester 1-(4-bromo-5-methoxy-5-methyl-2-oxofuran-3-yl)butyl acetate 1-(4-bromo-5-methoxy-5-methyl-2-oxo-3-furyl)butyl acetate 1-(4-bromanyl-5-methoxy-5-methyl-2-oxidanylidene-furan-3-yl)butyl ethanoate
Wiley ID 789064