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6-Methoxy-2,2-dimethyl-7-(methylthio)-3,4-dihydro-2H-1-benzopyran-4-one
SpectraBase Compound ID 4TAFW6fw764
InChI InChI=1S/C13H16O3S/c1-13(2)7-9(14)8-5-11(15-3)12(17-4)6-10(8)16-13/h5-6H,7H2,1-4H3
InChIKey WZNWVPPAKLCQHJ-UHFFFAOYSA-N
Mol Weight 252.33 g/mol
Molecular Formula C13H16O3S
Exact Mass 252.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KRMzYbRj5lK
Name 6-Methoxy-2,2-dimethyl-7-(methylthio)-3,4-dihydro-2H-1-benzopyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3S
InChI InChI=1S/C13H16O3S/c1-13(2)7-9(14)8-5-11(15-3)12(17-4)6-10(8)16-13/h5-6H,7H2,1-4H3
InChIKey WZNWVPPAKLCQHJ-UHFFFAOYSA-N
Molecular Weight 252.328 g/mol
SMILES C1(CC(c2cc(c(cc2O1)SC)OC)=O)(C)C
SPLASH splash10-0f79-0490000000-bff7f740616c0417dfab
Source of Spectrum SO-0-839-8
Synonyms 6-Methoxy-2,2-dimethyl-7-(methylthio)chroman-4-one 6-Methoxy-2,2-dimethyl-7-methylsulfanyl-3H-chromen-4-one 6-Methoxy-2,2-dimethyl-7-methylsulfanyl-chroman-4-one
Wiley ID 1545121