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beta-CYANO-alpha-HYDROXY-p-tert-BUTYLCINNAMIC ACID, ETHYL ESTER
SpectraBase Compound ID EnWc61JTCfb
InChI InChI=1S/C16H19NO3/c1-5-20-15(19)14(18)13(10-17)11-6-8-12(9-7-11)16(2,3)4/h6-9,18H,5H2,1-4H3
InChIKey BWKGZHYPIUYSJQ-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQlPnXquRIm
Name beta-CYANO-alpha-HYDROXY-p-tert-BUTYLCINNAMIC 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 C16H19NO3
InChI InChI=1S/C16H19NO3/c1-5-20-15(19)14(18)13(10-17)11-6-8-12(9-7-11)16(2,3)4/h6-9,18H,5H2,1-4H3
InChIKey BWKGZHYPIUYSJQ-UHFFFAOYSA-N
Melting Point 76-77.5C
Molecular Weight 273.33
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CINNAMIC ACID, B-CYANO-A-HYDROXY- P-/TERT-BUTYL/-, ETHYL ESTER