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4,11-Bis(ethoxycarbonylmethoxy)dibicyclo[2.2.1]hepteno[b,g]naphthalene
SpectraBase Compound ID AUJkMl6no4Q
InChI InChI=1S/C28H28O6/c1-3-31-23(29)13-33-27-21-11-19-15-5-6-16(9-15)20(19)12-22(21)28(34-14-24(30)32-4-2)26-18-8-7-17(10-18)25(26)27/h5-8,11-12,15-18H,3-4,9-10,13-14H2,1-2H3/t15-,16+,17+,18-
InChIKey FKECGQNBTQISHR-FZDBZEDMSA-N
Mol Weight 460.53 g/mol
Molecular Formula C28H28O6
Exact Mass 460.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Id9TZau045k
Name 4,11-Bis(ethoxycarbonylmethoxy)dibicyclo[2.2.1]hepteno[b,g]naphthalene
Comments Less than 3 mono-isotopic peaks
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Formula C28H28O6
InChI InChI=1S/C28H28O6/c1-3-31-23(29)13-33-27-21-11-19-15-5-6-16(9-15)20(19)12-22(21)28(34-14-24(30)32-4-2)26-18-8-7-17(10-18)25(26)27/h5-8,11-12,15-18H,3-4,9-10,13-14H2,1-2H3/t15-,16+,17+,18-
InChIKey FKECGQNBTQISHR-FZDBZEDMSA-N
Molecular Weight 460.526 g/mol
SMILES c12c(c(OCC(=O)OCC)c3c(c2OCC(=O)OCC)cc2c([C@@]4(C=C[C@]2(C4)[H])[H])c3)[C@@]2(C[C@]1(C=C2)[H])[H]
SPLASH splash10-0229-0009800000-0cce7be9c1872f5d4926
Source of Spectrum K1-2004-1418-5
Wiley ID 1560622