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5-acetyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester

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5-acetyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester
SpectraBase Compound ID 73XPXbXMAK0
InChI InChI=1S/C16H17NO3/c1-10-11(2)15(17-14(10)12(3)18)16(19)20-9-13-7-5-4-6-8-13/h4-8,17H,9H2,1-3H3
InChIKey HAMQKGHLETUXPS-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rVxonMCc8T
Name 2-Carbobenzyloxy-3,4-dimethyl-5-acetyl-pyrrole
CAS Registry Number 53700-94-0
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c1-10-11(2)15(17-14(10)12(3)18)16(19)20-9-13-7-5-4-6-8-13/h4-8,17H,9H2,1-3H3
InChIKey HAMQKGHLETUXPS-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference R.J. Abraham, R.D. Lapper, J. Chem. Soc. Perkin II 1004 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3