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Hydrocinnamic acid, cholesteryl ester

View entire compound with spectra: 4 NMR, and 1 FTIR

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 HzA3p4Gv0cC
Name Hydrocinnamic acid, cholesteryl ester
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 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
Melting Point 110C
Molecular Weight 518.83
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms HYDROCINNAMIC ACID, CHOLESTERYL ESTER CHOLESTEROL, HYDROCINNAMATE