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(3S,5S)-5-(4-methoxyphenyl)-3,5-dimethyl-2-oxolanone
SpectraBase Compound ID FbEUBYZeOCM
InChI InChI=1S/C13H16O3/c1-9-8-13(2,16-12(9)14)10-4-6-11(15-3)7-5-10/h4-7,9H,8H2,1-3H3/t9-,13-/m0/s1
InChIKey OOSYSZHXDWAOAY-ZANVPECISA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sj1X91cN6B
Name (3S,5S)-5-(4-methoxyphenyl)-3,5-dimethyl-2-oxolanone
Alternate Name(s) (3S,5S)-5-(4-methoxyphenyl)-3,5-dimethyl-oxolan-2-one (3S,5S)-5-(4-methoxyphenyl)-3,5-dimethyl-tetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-9-8-13(2,16-12(9)14)10-4-6-11(15-3)7-5-10/h4-7,9H,8H2,1-3H3/t9-,13-/m0/s1
InChIKey OOSYSZHXDWAOAY-ZANVPECISA-N
Molecular Weight 220.268 g/mol
SMILES [C@]1(OC([C@](C1)(C)[H])=O)(c1ccc(cc1)OC)C
SPLASH splash10-052r-2970000000-1cdd7c5af17230eacee1
Source of Spectrum J-66-3960-26
Wiley ID 1535322