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2-(4'-CYANOPHENYL)-INDOLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID FQ79grtCqlG
InChI InChI=1S/C20H18N2O2/c1-20(2,3)24-19(23)22-17-7-5-4-6-16(17)12-18(22)15-10-8-14(13-21)9-11-15/h4-12H,1-3H3
InChIKey SUJZQULQENLPPI-UHFFFAOYSA-N
Mol Weight 318.38 g/mol
Molecular Formula C20H18N2O2
Exact Mass 318.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpP8CaVrDFD
Name 2-(4'-CYANOPHENYL)-INDOLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18N2O2
InChI InChI=1S/C20H18N2O2/c1-20(2,3)24-19(23)22-17-7-5-4-6-16(17)12-18(22)15-10-8-14(13-21)9-11-15/h4-12H,1-3H3
InChIKey SUJZQULQENLPPI-UHFFFAOYSA-N
Literature Reference Author S.E.DENMARK,J.D.BAIRD
Literature Reference Citation ORG.LETTERS,8,793(2006)
Literature Reference DOI 10.1021/ol053165r
Molecular Weight 318.375 g/mol
Sample ID 60385
Solvent CDCl3