![4-[[(3-trimethylsilyloxy)-1-oxo-5Z, 8Z, 11Z, 14Z-eicosatetraenyl]amino]-butanoic acid, trimethylsilyl ester](/api/spectrum/ICVAWs47kvQ/structure.png?h=300&w=458 "4-[[(3-trimethylsilyloxy)-1-oxo-5Z, 8Z, 11Z, 14Z-eicosatetraenyl]amino]-butanoic acid, trimethylsilyl ester")
| SpectraBase Compound ID | 2UXQrnSas6Y |
|---|---|
| InChI | InChI=1S/C30H55NO4Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29(32)31-27-28(34-36(2,3)4)26-30(33)35-37(5,6)7/h12-13,15-16,18-19,21-22,28H,8-11,14,17,20,23-27H2,1-7H3,(H,31,32)/b13-12-,16-15-,19-18-,22-21- |
| InChIKey | DDDSQXAIFRWZSU-SYNYMFHXSA-N |
| Mol Weight | 549.9 g/mol |
| Molecular Formula | C30H55NO4Si2 |
| Exact Mass | 549.366962 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ICVAWs47kvQ |
|---|---|
| Name | 4-[[(3-trimethylsilyloxy)-1-oxo-5Z, 8Z, 11Z, 14Z-eicosatetraenyl]amino]-butanoic acid, trimethylsilyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 549.366962321 u |
| Formula | C30H55NO4Si2 |
| InChI | InChI=1S/C30H55NO4Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29(32)31-27-28(34-36(2,3)4)26-30(33)35-37(5,6)7/h12-13,15-16,18-19,21-22,28H,8-11,14,17,20,23-27H2,1-7H3,(H,31,32)/b13-12-,16-15-,19-18-,22-21- |
| InChIKey | DDDSQXAIFRWZSU-SYNYMFHXSA-N |
| Molecular Weight | 549.943 g/mol |
| SMILES | C(\C=C/C\C=C/C\C=C/CCCCC)\C=C/CCCC(=O)NCC(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C |