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7-Methyl-3-[(S)-(4-methylphenyl)sulfinyl]-1-benzopyran-2-one
SpectraBase Compound ID EveILTzNObS
InChI InChI=1S/C17H14O3S/c1-11-4-7-14(8-5-11)21(19)16-10-13-6-3-12(2)9-15(13)20-17(16)18/h3-10H,1-2H3
InChIKey DSAAZNAUTZWRCP-UHFFFAOYSA-N
Mol Weight 298.36 g/mol
Molecular Formula C17H14O3S
Exact Mass 298.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yFE8grAMlN
Name 7-Methyl-3-[(S)-(4-methylphenyl)sulfinyl]-1-benzopyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O3S
InChI InChI=1S/C17H14O3S/c1-11-4-7-14(8-5-11)21(19)16-10-13-6-3-12(2)9-15(13)20-17(16)18/h3-10H,1-2H3
InChIKey DSAAZNAUTZWRCP-UHFFFAOYSA-N
Molecular Weight 298.356 g/mol
SMILES C=1(C(Oc2c(C1)ccc(C)c2)=O)[S@](c1ccc(cc1)C)=O
SPLASH splash10-000m-8940000000-cf58e3a1a964c175449c
Source of Spectrum KD-16-1437-6
Synonyms 7-Methyl-3-[(S)-(4-methylphenyl)sulfinyl]chromen-2-one 7-Methyl-3-[(S)-p-tolylsulfinyl]chromen-2-one 7-Methyl-3-[(S)-p-tolylsulfinyl]coumarin
Wiley ID 1637638