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6,13-Dibenzoyloxy-tetradeca-2,4,8-trien-1-ol
SpectraBase Compound ID GT41ZsfuWZ3
InChI InChI=1S/C28H32O5/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/h3-6,8-14,16-19,21,23,26,29H,2,7,15,20,22H2,1H3/b12-3+,14-6+,21-13+/t23?,26-/m1/s1
InChIKey PNDFVMMUHMERIA-WKYRYOBDSA-N
Mol Weight 448.6 g/mol
Molecular Formula C28H32O5
Exact Mass 448.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhRCT0UHp56
Name 6,13-Dibenzoyloxy-tetradeca-2,4,8-trien-1-ol
Alternate Name(s) (5E,9E,11E)-8-(benzoyloxy)-13-hydroxy-1-methyl-5,9,11-tridecatrienyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O5
InChI InChI=1S/C28H32O5/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/h3-6,8-14,16-19,21,23,26,29H,2,7,15,20,22H2,1H3/b12-3+,14-6+,21-13+/t23?,26-/m1/s1
InChIKey PNDFVMMUHMERIA-WKYRYOBDSA-N
Molecular Weight 448.559 g/mol
SMILES OC\C=C\C=C\[C@](OC(=O)c1ccccc1)(C\C=C\CCCC(OC(=O)c1ccccc1)C)[H]
SPLASH splash10-0a4i-2902000000-1be7cc7019f78c6ad748
Source of Spectrum AC-1990-803-8
Wiley ID 747861