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2-(1,3-Diphenyl-3-oxopropyl)-2-hexyl-malonic acid, diethyl ester

View entire compound with spectra: 1 NMR

2-(1,3-Diphenyl-3-oxopropyl)-2-hexyl-malonic acid, diethyl ester
SpectraBase Compound ID HLVMGUTFEy
InChI InChI=1S/C26H32O5/c1-4-7-18-26(24(28)30-5-2,25(29)31-6-3)22(20-14-10-8-11-15-20)19-23(27)21-16-12-9-13-17-21/h8-17,22H,4-7,18-19H2,1-3H3
InChIKey XUGYARFUFDEIBR-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C26H32O5
Exact Mass 424.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VONOgtBdmm
Name 2-(1,3-Diphenyl-3-oxopropyl)-2-hexyl-malonic acid, diethyl ester
CAS Registry Number 75919-30-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H32O5
InChI InChI=1S/C26H32O5/c1-4-7-18-26(24(28)30-5-2,25(29)31-6-3)22(20-14-10-8-11-15-20)19-23(27)21-16-12-9-13-17-21/h8-17,22H,4-7,18-19H2,1-3H3
InChIKey XUGYARFUFDEIBR-UHFFFAOYSA-N
Literature Reference K. Matsumoto, Angew. Chem. 92, 1046 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3