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(2RS,5SR,8SR)-(E,E)-5-DIPHENYLPHOSPHONYL-NONA-3,6-DIENE-2,8-DIYL-DIACETATE;anti-anti-ISOMER
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)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UAs39SYJzz
Name Acetic acid (2E,5E)-(1S,7R)-7-acetoxy-4-(diphenyl-phosphinoyl)-1-methyl-octa-2,5-dienyl ester
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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 splash10-0f9i-0496200000-3ab8396b4878c1236381
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 781278