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(E)-5-FLUORO-2-METHYL-1-[[PARA-(METHYLTHIO)-PHENYL]-METHYLENE]-1H-INDENE-3-ACETIC-ACID;DESOXY-ISOSULINDAC
SpectraBase Compound ID DZGzk6Eb8Dq
InChI InChI=1S/C20H17FO2S/c1-12-17(9-13-3-6-15(24-2)7-4-13)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9+
InChIKey LFWHFZJPXXOYNR-RQZCQDPDSA-N
Mol Weight 340.41 g/mol
Molecular Formula C20H17FO2S
Exact Mass 340.093329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kq35pGJKV4z
Name (E)-5-FLUORO-2-METHYL-1-[[PARA-(METHYLTHIO)-PHENYL]-METHYLENE]-1H-INDENE-3-ACETIC-ACID;DESOXY-ISOSULINDAC
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17FO2S
InChI InChI=1S/C20H17FO2S/c1-12-17(9-13-3-6-15(24-2)7-4-13)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9+
InChIKey LFWHFZJPXXOYNR-RQZCQDPDSA-N
Literature Reference Author A.W.DOUGLAS
Literature Reference Citation CAN.J.CHEM.,56,2129(1978)
Literature Reference DOI 10.1139/v78-348
Molecular Weight 340.412 g/mol
Solvent DMSO-D6
Source File Reference UWED3822