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3-[2-Oxo-1-(4-methylphenylsulfonyl)propylidene]-2-benzofuran-1-one
SpectraBase Compound ID 5kj01g8rUS4
InChI InChI=1S/C18H14O5S/c1-11-7-9-13(10-8-11)24(21,22)17(12(2)19)16-14-5-3-4-6-15(14)18(20)23-16/h3-10H,1-2H3/b17-16+
InChIKey JLJLEXSDUPDCRR-WUKNDPDISA-N
Mol Weight 342.37 g/mol
Molecular Formula C18H14O5S
Exact Mass 342.056195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuhnssAn58s
Name 3-[2-Oxo-1-(4-methylphenylsulfonyl)propylidene]-2-benzofuran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O5S
InChI InChI=1S/C18H14O5S/c1-11-7-9-13(10-8-11)24(21,22)17(12(2)19)16-14-5-3-4-6-15(14)18(20)23-16/h3-10H,1-2H3/b17-16+
InChIKey JLJLEXSDUPDCRR-WUKNDPDISA-N
Molecular Weight 342.365 g/mol
SMILES c1(S(\C(=C/2OC(=O)c3c2cccc3)C(=O)C)(=O)=O)ccc(cc1)C
SPLASH splash10-0udi-0039000000-e2c3dfe04e4647dd2575
Source of Spectrum F4-43-2290-7b
Wiley ID 1675899