John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1eSeZniRwER SpectraBase Spectrum ID=10zOM4Em7xp

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2-TRIFLUOROMETHYL-2-METHOXYCARBONYL-INDAN-1-ONE
SpectraBase Compound ID 1eSeZniRwER
InChI InChI=1S/C12H9F3O3/c1-18-10(17)11(12(13,14)15)6-7-4-2-3-5-8(7)9(11)16/h2-5H,6H2,1H3
InChIKey PIPFYXGPIBROMU-UHFFFAOYSA-N
Mol Weight 258.2 g/mol
Molecular Formula C12H9F3O3
Exact Mass 258.050379 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10zOM4Em7xp
Name 2-TRIFLUOROMETHYL-2-METHOXYCARBONYL-INDAN-1-ONE
Compound Number 5A
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9F3O3
InChI InChI=1S/C12H9F3O3/c1-18-10(17)11(12(13,14)15)6-7-4-2-3-5-8(7)9(11)16/h2-5H,6H2,1H3
InChIKey PIPFYXGPIBROMU-UHFFFAOYSA-N
Literature Reference Author J.A.MA,D.CAHARD
Literature Reference Citation J.ORG.CHEM.,68,8726(2003)
Literature Reference DOI 10.1021/jo034881e
Solvent CDCl3
Source File Reference UWSI21123
SpectraBase Batch ID 7uvOL7Sqmkc