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2-acetyl-2-(2-cyanoethyl)glutaric acid, 1-ethyl methyl ester

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2-acetyl-2-(2-cyanoethyl)glutaric acid, 1-ethyl methyl ester
SpectraBase Compound ID 6R6oaIGR6IG
InChI InChI=1S/C13H19NO5/c1-4-19-12(17)13(10(2)15,7-5-9-14)8-6-11(16)18-3/h4-8H2,1-3H3
InChIKey HCESWJHJWYSATN-UHFFFAOYSA-N
Mol Weight 269.3 g/mol
Molecular Formula C13H19NO5
Exact Mass 269.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eTcwoZOhLc
Name 2-ACETYL-2-(2-CYANOETHYL)GLUTARIC ACID, 1-ETHYL METHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 152-153C/0.2mm
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO5
InChI InChI=1S/C13H19NO5/c1-4-19-12(17)13(10(2)15,7-5-9-14)8-6-11(16)18-3/h4-8H2,1-3H3
InChIKey HCESWJHJWYSATN-UHFFFAOYSA-N
Molecular Weight 269.30
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms GLUTARIC ACID, 2-ACETYL-2-/2-CYANOETHYL/-, 1-ETHYL METHYL ESTER