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(3R,5S)-3-Methyl-5-(toluene-4-sulfinyl)-dihydro-furan-2-one
SpectraBase Compound ID 4Ja7jewFtmH
InChI InChI=1S/C12H14O3S/c1-8-3-5-10(6-4-8)16(14)11-7-9(2)12(13)15-11/h3-6,9,11H,7H2,1-2H3/t9-,11+,16?/m1/s1
InChIKey YFTADOAABSZGFL-QFDGKBFMSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IgGcioLtUxP
Name (3R,5S)-3-Methyl-5-(toluene-4-sulfinyl)-dihydro-furan-2-one
Alternate Name(s) 3-Methyl-5-(p-tolylsulfinyl)dihydrofuran-2-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-8-3-5-10(6-4-8)16(14)11-7-9(2)12(13)15-11/h3-6,9,11H,7H2,1-2H3/t9-,11+,16?/m1/s1
InChIKey YFTADOAABSZGFL-QFDGKBFMSA-N
Molecular Weight 238.301 g/mol
SMILES [C@@]1(OC(=O)[C@@](C1)(C)[H])(S(c1ccc(cc1)C)=O)[H]
SPLASH splash10-0072-9860000000-b089b990724b31e932b9
Source of Spectrum F4-41-1333-34b
Wiley ID 1672039