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2-butyl-2-cyanohexanoic acid, ethyl ester

View entire compound with spectra: 2 NMR, and 2 FTIR

2-butyl-2-cyanohexanoic acid, ethyl ester
SpectraBase Compound ID J8fHqljdGsn
InChI InChI=1S/C13H23NO2/c1-4-7-9-13(11-14,10-8-5-2)12(15)16-6-3/h4-10H2,1-3H3
InChIKey WLLOYTIHTJTCCF-UHFFFAOYSA-N
Mol Weight 225.33 g/mol
Molecular Formula C13H23NO2
Exact Mass 225.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8nXf1zaRvEU
Name 2-BUTYL-2-CYANOHEXANOIC ACID, ETHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23NO2
InChI InChI=1S/C13H23NO2/c1-4-7-9-13(11-14,10-8-5-2)12(15)16-6-3/h4-10H2,1-3H3
InChIKey WLLOYTIHTJTCCF-UHFFFAOYSA-N
Molecular Weight 225.33
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms HEXANOIC ACID, 2-BUTYL-2-CYANO-, ETHYL ESTER