![9-Octadecenoic acid (Z)-, 1-[(1-octadecenyloxy)methyl]-2-[(trimethylsilyl)oxy]ethyl ester](/api/spectrum/48DYK6bd86c/structure.png?h=300&w=458 "9-Octadecenoic acid (Z)-, 1-[(1-octadecenyloxy)methyl]-2-[(trimethylsilyl)oxy]ethyl ester")
| SpectraBase Compound ID | 2aSxGIeTDnk |
|---|---|
| InChI | InChI=1S/C42H82O4Si/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-44-39-41(40-45-47(3,4)5)46-42(43)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,36,38,41H,6-20,22,24-35,37,39-40H2,1-5H3/b23-21-,38-36+ |
| InChIKey | KHDWSDYFOVAWBI-MZVSPUBLSA-N |
| Mol Weight | 679.2 g/mol |
| Molecular Formula | C42H82O4Si |
| Exact Mass | 678.598238 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48DYK6bd86c |
|---|---|
| Name | 9-Octadecenoic acid (Z)-, 1-[(1-octadecenyloxy)methyl]-2-[(trimethylsilyl)oxy]ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 678.598237651 u |
| Formula | C42H82O4Si |
| InChI | InChI=1S/C42H82O4Si/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-44-39-41(40-45-47(3,4)5)46-42(43)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,36,38,41H,6-20,22,24-35,37,39-40H2,1-5H3/b23-21-,38-36+ |
| InChIKey | KHDWSDYFOVAWBI-MZVSPUBLSA-N |
| Molecular Weight | 679.199 g/mol |
| SMILES | C(OC(CO[Si](C)(C)C)CO\C=C\CCCCCCCCCCCCCCCC)(=O)CCCCCCC\C=C/CCCCCCCC |