SpectraBase Compound ID | EnBFO638HHj |
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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 |
SpectraBase Spectrum ID | 2hkZqQFOiiG |
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Name | Hydrocinnamic acid, cholesteryl ester |
Copyright | Copyright © 2009-2024 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 |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 26993M |
Solvent | CDCl3 |