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(2E,4R,5S)-5-HYDROXY-4-METHYL-7-PHENYL-2,6-HEPTADIENOIC-ACID-TERT.-BUTYLESTER
SpectraBase Compound ID 8VomNpqX44n
InChI InChI=1S/C18H24O3/c1-14(10-13-17(20)21-18(2,3)4)16(19)12-11-15-8-6-5-7-9-15/h5-14,16,19H,1-4H3/b12-11+,13-10+/t14-,16+/m1/s1
InChIKey RBOZQWHCBDJLLB-MMUOTOFJSA-N
Mol Weight 288.39 g/mol
Molecular Formula C18H24O3
Exact Mass 288.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L5pGfZK8GXg
Name (2E,4R,5S)-5-HYDROXY-4-METHYL-7-PHENYL-2,6-HEPTADIENOIC-ACID-TERT.-BUTYLESTER
Compound Number 4DB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H24O3
InChI InChI=1S/C18H24O3/c1-14(10-13-17(20)21-18(2,3)4)16(19)12-11-15-8-6-5-7-9-15/h5-14,16,19H,1-4H3/b12-11+,13-10+/t14-,16+/m1/s1
InChIKey RBOZQWHCBDJLLB-MMUOTOFJSA-N
Literature Reference Author S.E.DENMARK,G.L.BEUTNER
Literature Reference Citation J.AM.CHEM.SOC.,125,7800(2003)
Literature Reference DOI 10.1021/ja035448p
Molecular Weight 288.387 g/mol
Sample ID 41570
Solvent CDCl3