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1,2,4-Butanetricarboxylic acid, 1,4-bis[(3-cyclohexen-1-yl)-methyl]-2-ethyl-hexyl ester

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1,2,4-Butanetricarboxylic acid, 1,4-bis[(3-cyclohexen-1-yl)-methyl]-2-ethyl-hexyl ester
SpectraBase Compound ID 20YtvHLFkzo
InChI InChI=1S/C29H46O6/c1-3-5-12-23(4-2)20-35-29(32)26(19-28(31)34-22-25-15-10-7-11-16-25)17-18-27(30)33-21-24-13-8-6-9-14-24/h6-8,10,23-26H,3-5,9,11-22H2,1-2H3
InChIKey CLXJABYQKDRHRW-UHFFFAOYSA-N
Mol Weight 490.7 g/mol
Molecular Formula C29H46O6
Exact Mass 490.329439 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5Q7UwcP82p
Name 1,2,4-Butanetricarboxylic acid, 1,4-bis[(3-cyclohexen-1-yl)-methyl]-2-ethyl-hexyl ester
CAS Registry Number 97157-59-0
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H46O6
InChI InChI=1S/C29H46O6/c1-3-5-12-23(4-2)20-35-29(32)26(19-28(31)34-22-25-15-10-7-11-16-25)17-18-27(30)33-21-24-13-8-6-9-14-24/h6-8,10,23-26H,3-5,9,11-22H2,1-2H3
InChIKey CLXJABYQKDRHRW-UHFFFAOYSA-N
Instrument Name Varian CFT-20
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3