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3-Acetyl-4-hydroxy-5-hexylfuran-2(5H)-one
SpectraBase Compound ID 791UaW61uJj
InChI InChI=1S/C12H18O4/c1-3-4-5-6-7-9-11(14)10(8(2)13)12(15)16-9/h9,14H,3-7H2,1-2H3
InChIKey AVSUKYLMADAHPX-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5c2glUtXvLx
Name 3-Acetyl-4-hydroxy-5-hexylfuran-2(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-3-4-5-6-7-9-11(14)10(8(2)13)12(15)16-9/h9,14H,3-7H2,1-2H3
InChIKey AVSUKYLMADAHPX-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES OC1=C(C(OC1CCCCCC)=O)C(=O)C
SPLASH splash10-0006-0900000000-0ef7b4415b31e9c8eba2
Source of Spectrum F4-0-3909-12
Synonyms 3-Acetyl-5-hexyl-4-hydroxy-2(5H)-furanone 4-Ethanoyl-2-hexyl-3-oxidanyl-2H-furan-5-one
Wiley ID 1621123