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7-Methoxy-6-methyl-3-(phenylthio)isobenzofuran-1(3H)-one
SpectraBase Compound ID KEzjP0phBSe
InChI InChI=1S/C16H14O3S/c1-10-8-9-12-13(14(10)18-2)15(17)19-16(12)20-11-6-4-3-5-7-11/h3-9,16H,1-2H3
InChIKey DXQHIRYGKZGJDC-UHFFFAOYSA-N
Mol Weight 286.35 g/mol
Molecular Formula C16H14O3S
Exact Mass 286.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwXuJU6MyVz
Name 7-Methoxy-6-methyl-3-(phenylthio)isobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O3S
InChI InChI=1S/C16H14O3S/c1-10-8-9-12-13(14(10)18-2)15(17)19-16(12)20-11-6-4-3-5-7-11/h3-9,16H,1-2H3
InChIKey DXQHIRYGKZGJDC-UHFFFAOYSA-N
Molecular Weight 286.345 g/mol
SMILES c12C(OC(c2ccc(c1OC)C)Sc1ccccc1)=O
SPLASH splash10-004i-0910000000-17fc61c933e39f3c53ba
Source of Spectrum U-1995-91-9
Synonyms 7-Methoxy-6-methyl-3-(phenylsulfanyl)-2-benzofuran-1(3H)-one
Wiley ID 766377