![2,2,2-Trichloroethyl ester of N-[(1-oxo-5-(tert-butylcdimethylsilyloxy)-6-methyl-8-phenyl)octa-2,7-dienyl]-O-methyl-D-tyrosine](/api/spectrum/AzfM8pQa7lJ/structure.png?h=300&w=458 "2,2,2-Trichloroethyl ester of N-[(1-oxo-5-(tert-butylcdimethylsilyloxy)-6-methyl-8-phenyl)octa-2,7-dienyl]-O-methyl-D-tyrosine")
| SpectraBase Compound ID | L8mifPXnMHt |
|---|---|
| InChI | InChI=1S/C33H44Cl3NO5Si/c1-24(16-17-25-12-9-8-10-13-25)29(42-43(6,7)32(2,3)4)14-11-15-30(38)37-28(31(39)41-23-33(34,35)36)22-26-18-20-27(40-5)21-19-26/h8-13,15-21,24,28-29H,14,22-23H2,1-7H3,(H,37,38)/b15-11+,17-16+/t24?,28-,29?/m1/s1 |
| InChIKey | ZWRAIWNLEQYTCH-HJUTZOBUSA-N |
| Mol Weight | 669.2 g/mol |
| Molecular Formula | C33H44Cl3NO5Si |
| Exact Mass | 667.205433 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AzfM8pQa7lJ |
|---|---|
| Name | 2,2,2-Trichloroethyl ester of N-[(1-oxo-5-(tert-butylcdimethylsilyloxy)-6-methyl-8-phenyl)octa-2,7-dienyl]-O-methyl-D-tyrosine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H44Cl3NO5Si |
| InChI | InChI=1S/C33H44Cl3NO5Si/c1-24(16-17-25-12-9-8-10-13-25)29(42-43(6,7)32(2,3)4)14-11-15-30(38)37-28(31(39)41-23-33(34,35)36)22-26-18-20-27(40-5)21-19-26/h8-13,15-21,24,28-29H,14,22-23H2,1-7H3,(H,37,38)/b15-11+,17-16+/t24?,28-,29?/m1/s1 |
| InChIKey | ZWRAIWNLEQYTCH-HJUTZOBUSA-N |
| Molecular Weight | 669.161 g/mol |
| SMILES | N([C@@](C(OCC(Cl)(Cl)Cl)=O)(Cc1ccc(cc1)OC)[H])C(\C=C\CC(O[Si](C(C)(C)C)(C)C)C(\C=C\c1ccccc1)C)=O |
| SPLASH | splash10-01x9-0921000000-7b1881e447aec1a9dc2f |
| Source of Spectrum | C-117-2487-20 |
| Wiley ID | 758768 |