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2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]-1,2-dihydroinden-1-yl]ethanoic acid
SpectraBase Compound ID 1jyvkSpbBdW
InChI InChI=1S/C20H19FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10,12,18H,11H2,1-2H3,(H,22,23)/b17-9-
InChIKey DBXXOGKNHWRTLL-MFOYZWKCSA-N
Mol Weight 358.43 g/mol
Molecular Formula C20H19FO3S
Exact Mass 358.103894 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JQsLaGlKY0b
Name 2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]-1,2-dihydroinden-1-yl]ethanoic acid
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Formula C20H19FO3S
InChI InChI=1S/C20H19FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10,12,18H,11H2,1-2H3,(H,22,23)/b17-9-
InChIKey DBXXOGKNHWRTLL-MFOYZWKCSA-N
Molecular Weight 358.427 g/mol
SMILES OC(CC1c2cc(ccc2\C(=C/c2ccc(cc2)S(C)=O)C1C)F)=O
SPLASH splash10-01qa-0392000000-2c9e82053b70a472da07
Synonyms 2-[(3Z)-6-fluoro-2-methyl-3-(4-methylsulfinylbenzylidene)indan-1-yl]acetic acid 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylene]indan-1-yl]acetic acid 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]-1,2-dihydroinden-1-yl]acetic acid
Wiley ID 1507802