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(3R,4S,5S)-3-acetyl-5-methyl-4-phenacyl-2-oxolanone
SpectraBase Compound ID FeUEe4eH3E7
InChI InChI=1S/C15H16O4/c1-9(16)14-12(10(2)19-15(14)18)8-13(17)11-6-4-3-5-7-11/h3-7,10,12,14H,8H2,1-2H3/t10-,12+,14-/m0/s1
InChIKey SMYZPRFXTWJVFE-SUHUHFCYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C15H16O4
Exact Mass 260.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UXqvklyP6n
Name (3R,4S,5S)-3-acetyl-5-methyl-4-phenacyl-2-oxolanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O4
InChI InChI=1S/C15H16O4/c1-9(16)14-12(10(2)19-15(14)18)8-13(17)11-6-4-3-5-7-11/h3-7,10,12,14H,8H2,1-2H3/t10-,12+,14-/m0/s1
InChIKey SMYZPRFXTWJVFE-SUHUHFCYSA-N
Molecular Weight 260.289 g/mol
SMILES C1([C@]([C@](CC(=O)c2ccccc2)([C@@](O1)(C)[H])[H])(C(=O)C)[H])=O
SPLASH splash10-0a4i-0920000000-bcd337f5a699435266bf
Source of Spectrum J-67-5313-22
Synonyms (3R,4S,5S)-3-acetyl-5-methyl-4-phenacyl-tetrahydrofuran-2-one (3R,4S,5S)-3-acetyl-5-methyl-4-phenacyloxolan-2-one (3R,4S,5S)-3-ethanoyl-5-methyl-4-phenacyl-oxolan-2-one
Wiley ID 1570436