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Benzyl-5-formyl-3-methyl-4-octyl-2-pyrrole-carboxylate

View entire compound with spectra: 2 NMR

Benzyl-5-formyl-3-methyl-4-octyl-2-pyrrole-carboxylate
SpectraBase Compound ID 4jJFQtyXtt2
InChI InChI=1S/C22H29NO3/c1-3-4-5-6-7-11-14-19-17(2)21(23-20(19)15-24)22(25)26-16-18-12-9-8-10-13-18/h8-10,12-13,15,23H,3-7,11,14,16H2,1-2H3
InChIKey HLUZRJCCZYYNRS-UHFFFAOYSA-N
Mol Weight 355.48 g/mol
Molecular Formula C22H29NO3
Exact Mass 355.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ht7xYcBkUyI
Name Benzyl-5-formyl-3-methyl-4-octyl-2-pyrrole-carboxylate
CAS Registry Number 113998-89-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H29NO3
InChI InChI=1S/C22H29NO3/c1-3-4-5-6-7-11-14-19-17(2)21(23-20(19)15-24)22(25)26-16-18-12-9-8-10-13-18/h8-10,12-13,15,23H,3-7,11,14,16H2,1-2H3
InChIKey HLUZRJCCZYYNRS-UHFFFAOYSA-N
Instrument Name SF = 400 MHz
Literature Reference J. Org. Chem. 53, 2787 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3