| SpectraBase Compound ID | B87yaIY8Frf |
|---|---|
| InChI | InChI=1S/C25H29O5P/c1-19(29-21(3)26)15-17-25(18-16-20(2)30-22(4)27)31(28,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-20,25H,1-4H3/b17-15+,18-16+/t19-,20+,25- |
| InChIKey | XAKLGPMQWOQUKU-XQVBGQIZSA-N |
| Mol Weight | 440.48 g/mol |
| Molecular Formula | C25H29O5P |
| Exact Mass | 440.175261 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HeKCQhiV4AC |
|---|---|
| Name | Acetic acid (2E,5E)-(1S,7R)-7-acetoxy-4-(diphenyl-phosphinoyl)-1-methyl-octa-2,5-dienyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H29O5P |
| InChI | InChI=1S/C25H29O5P/c1-19(29-21(3)26)15-17-25(18-16-20(2)30-22(4)27)31(28,23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-20,25H,1-4H3/b17-15+,18-16+/t19-,20+,25- |
| InChIKey | XAKLGPMQWOQUKU-XQVBGQIZSA-N |
| Molecular Weight | 440.476 g/mol |
| SMILES | [C@](P(=O)(c1ccccc1)c1ccccc1)(\C=C\[C@@](OC(=O)C)(C)[H])(\C=C\[C@](OC(=O)C)(C)[H])[H] |
| SPLASH | splash10-0w30-0094100000-8beb1e36e50e91fa1067 |
| Source of Spectrum | KC-0-1539-29 |
| Synonyms | (1R,2E,5E,7S)-7-(acetyloxy)-4-(diphenylphosphoryl)-1-methyl-2,5-octadienyl acetate (2RS,5SR,8SR)-(E,E)-5-Diphenylphosphinoylnona-3,6-diene-2,8-diyl diacetate (2SR,8SR)-(E,E)-5-Diphenylphosphinoylnona-3,6-diene-2,8-diyl diacetate Acetic acid[(1S,2E,5E,7R)-7-acetoxy-4-diphenylphosphoryl-1-methyl-octa-2,5-dienyl]ester Acetic acid[(2S,3E,6E,8R)-8-acetyloxy-5-diphenylphosphorylnona-3,6-dien-2-yl]ester [(1S,2E,5E,7R)-7-acetoxy-4-diphenylphosphoryl-1-methyl-octa-2,5-dienyl]acetate [(2S,3E,6E,8R)-8-acetyloxy-5-diphenylphosphoryl-nona-3,6-dien-2-yl]ethanoate [(2S,3E,6E,8R)-8-acetyloxy-5-diphenylphosphorylnona-3,6-dien-2-yl]acetate |
| Wiley ID | 781277 |