SpectraBase Compound ID | BMalokizeNm |
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InChI | InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1 |
InChIKey | WCLNGBQPTVENHV-MKQVXYPISA-N |
Mol Weight | 526.9 g/mol |
Molecular Formula | C36H62O2 |
Exact Mass | 526.474981 g/mol |
SpectraBase Spectrum ID | Hp86KtbYeTO |
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Name | Cholesteryl pelargonate |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | C78801 |
CAS Registry Number | 1182-66-7 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C36H62O2 |
InChI | InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1 |
InChIKey | WCLNGBQPTVENHV-MKQVXYPISA-N |
Observed nucleus | 13C |
Purity | 97% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Synonyms | 3beta-Hydroxy-5-cholestene 3-nonanoate 5-Cholesten-3beta-ol 3-nonanoate Cholesteryl nonanoate |
Wiley ID | SIAL_13CNMR_011224 |