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Hydrocinnamic acid, cholesteryl ester
SpectraBase Compound ID EnBFO638HHj
InChI InChI=1S/C36H54O2/c1-25(2)10-9-11-26(3)31-17-18-32-30-16-15-28-24-29(38-34(37)19-14-27-12-7-6-8-13-27)20-22-35(28,4)33(30)21-23-36(31,32)5/h6-8,12-13,15,25-26,29-33H,9-11,14,16-24H2,1-5H3/t26-,29+,30+,31-,32+,33+,35+,36-/m1/s1
InChIKey KPNKAGLPVPTLGB-ZOJFKXTHSA-N
Mol Weight 518.8 g/mol
Molecular Formula C36H54O2
Exact Mass 518.412381 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bxz0DLfo3Dr
Name Cholesteryl hydrocinnamate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number C77902
CAS Registry Number 14914-99-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H54O2
InChI InChI=1S/C36H54O2/c1-25(2)10-9-11-26(3)31-17-18-32-30-16-15-28-24-29(38-34(37)19-14-27-12-7-6-8-13-27)20-22-35(28,4)33(30)21-23-36(31,32)5/h6-8,12-13,15,25-26,29-33H,9-11,14,16-24H2,1-5H3/t26-,29+,30+,31-,32+,33+,35+,36-/m1/s1
InChIKey KPNKAGLPVPTLGB-ZOJFKXTHSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3beta-Hydroxy-5-cholestene 3-hydrocinnamate 5-Cholesten-3beta-ol 3-hydrocinnamate Cholesteryl phenylpropionate
Wiley ID SIAL_13CNMR_011222