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6,13-Dibenzoyloxy-tetradeca-2,4,8-trienal
SpectraBase Compound ID 7pgGcPSA8dz
InChI InChI=1S/C28H30O5/c1-23(32-27(30)24-16-8-4-9-17-24)15-7-2-3-12-20-26(21-13-6-14-22-29)33-28(31)25-18-10-5-11-19-25/h3-6,8-14,16-19,21-23,26H,2,7,15,20H2,1H3/b12-3+,14-6+,21-13+/t23?,26-/m1/s1
InChIKey FRBFPXWKQCQYMN-WKYRYOBDSA-N
Mol Weight 446.54 g/mol
Molecular Formula C28H30O5
Exact Mass 446.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NckYcB64il
Name 6,13-Dibenzoyloxy-tetradeca-2,4,8-trienal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30O5
InChI InChI=1S/C28H30O5/c1-23(32-27(30)24-16-8-4-9-17-24)15-7-2-3-12-20-26(21-13-6-14-22-29)33-28(31)25-18-10-5-11-19-25/h3-6,8-14,16-19,21-23,26H,2,7,15,20H2,1H3/b12-3+,14-6+,21-13+/t23?,26-/m1/s1
InChIKey FRBFPXWKQCQYMN-WKYRYOBDSA-N
Molecular Weight 446.543 g/mol
SMILES C(OC(CCC\C=C\C[C@@](OC(=O)c1ccccc1)(\C=C\C=C\C=O)[H])C)(=O)c1ccccc1
SPLASH splash10-0a4i-1900000000-742b2349cdc5a23bfdf9
Source of Spectrum AC-1990-803-7
Synonyms (5E,9E,11E)-8-(benzoyloxy)-1-methyl-13-oxo-5,9,11-tridecatrienyl benzoate
Wiley ID 747862