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HYDROCINNAMIC ACID, B-ETHYL-B- HYDROXY-, TERT-BUTYL ESTER
SpectraBase Compound ID CaZL8cQbiZG
InChI InChI=1S/C15H22O3/c1-5-15(17,12-9-7-6-8-10-12)11-13(16)18-14(2,3)4/h6-10,17H,5,11H2,1-4H3
InChIKey MXLGBMFARDYLRN-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6fzzhfkQ3Vm
Name beta-ethyl-beta-hydroxyhydrocinnamic acid, tert-butyl ester
Source of Sample Y. Maroni-Barnaud, University of Toulouse, Toulouse, France
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Density (25C) 1.009
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-5-15(17,12-9-7-6-8-10-12)11-13(16)18-14(2,3)4/h6-10,17H,5,11H2,1-4H3
InChIKey MXLGBMFARDYLRN-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference Abstract-Chemical Abstracts= 66, 37579(1967)
Optical Properties Index of Refraction= (25C) 1.4843
Sadtler NMR Number 7155M
Solvent CCl4
Synonyms VALERIC ACID, 3-HYDROXY-3-PHENYL-, TERT-BUTYL ESTER HYDROCINNAMIC ACID, B-ETHYL-B- HYDROXY-, TERT-BUTYL ESTER