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1,2,4-butanetricarboxylic acid, 1,4-dicyclohexyl 2-(2-ethylhexyl) ester
SpectraBase Compound ID B5RSOIdiDmI
InChI InChI=1S/C27H46O6/c1-3-5-12-21(4-2)20-31-27(30)22(19-26(29)33-24-15-10-7-11-16-24)17-18-25(28)32-23-13-8-6-9-14-23/h21-24H,3-20H2,1-2H3
InChIKey JICKAGDNVHIDFI-UHFFFAOYSA-N
Mol Weight 466.7 g/mol
Molecular Formula C27H46O6
Exact Mass 466.329439 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ACTlRqfhxm
Name 1,2,4-butanetricarboxylic acid, 1,4-dicyclohexyl 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) 1.0265
Formula C27H46O6
InChI InChI=1S/C27H46O6/c1-3-5-12-21(4-2)20-31-27(30)22(19-26(29)33-24-15-10-7-11-16-24)17-18-25(28)32-23-13-8-6-9-14-23/h21-24H,3-20H2,1-2H3
InChIKey JICKAGDNVHIDFI-UHFFFAOYSA-N
Instrument Name Varian A-60
Optical Properties Index of Refraction= (30C) 1.4668
Sadtler NMR Number 7485M
Solvent CCl4
Synonyms BUTANETRICARBOXYLIC ACID, 1,2,4-, 1,4-DICYCLOHEXYL 2-/2-ETHYLHEXYL/ ESTER