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1,2,4-butanetricarboxylic acid, 1,4-bis(2-methylpentyl) 2-(2-ethylhexyl) ester
SpectraBase Compound ID I4F2OdvkYXH
InChI InChI=1S/C27H50O6/c1-7-11-14-23(10-4)20-33-27(30)24(17-26(29)32-19-22(6)13-9-3)15-16-25(28)31-18-21(5)12-8-2/h21-24H,7-20H2,1-6H3
InChIKey WEVQKQWCWFOYDO-UHFFFAOYSA-N
Mol Weight 470.7 g/mol
Molecular Formula C27H50O6
Exact Mass 470.360739 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUU6RD2oUpp
Name 1,2,4-butanetricarboxylic acid, 1,4-bis(2-methylpentyl) 2-(2-ethylhexyl) ester
Source of Sample R. L. Roberts & J. W. Lynn, Union Carbide Chemicals Company, New York, New York
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density (20/20C) 0.9658
Formula C27H50O6
InChI InChI=1S/C27H50O6/c1-7-11-14-23(10-4)20-33-27(30)24(17-26(29)32-19-22(6)13-9-3)15-16-25(28)31-18-21(5)12-8-2/h21-24H,7-20H2,1-6H3
InChIKey WEVQKQWCWFOYDO-UHFFFAOYSA-N
Instrument Name Varian A-60
Optical Properties Index of Refraction= (20C) 1.4462
Sadtler NMR Number 7480M
Solvent CCl4
Synonyms BUTANETRICARBOXYLIC ACID, 1,2,4-, 1,4-BIS/2-METHYLPENTYL/ 2-/2-ETHYL- HEXYL/ ESTER