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2-(2'-METHYLPHENYL)-PYRROLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID 8SEwdzh227w
InChI InChI=1S/C16H19NO2/c1-12-8-5-6-9-13(12)14-10-7-11-17(14)15(18)19-16(2,3)4/h5-11H,1-4H3
InChIKey MMFBSLLCHPUBMK-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 23pZPQ3NzN6
Name 2-(2'-METHYLPHENYL)-PYRROLE-1-CARBOXYLIC-ACID-TERT.-BUTYLESTER
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-12-8-5-6-9-13(12)14-10-7-11-17(14)15(18)19-16(2,3)4/h5-11H,1-4H3
InChIKey MMFBSLLCHPUBMK-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 257.332 g/mol
Sample ID 60388
Solvent CDCl3