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(11R,12R)-9,10-dihydro-9,10-ethanoanthracene-11,12-dimethyl bis((E)-3-phenylpropenoate)
SpectraBase Compound ID E9h2WPtb9w
InChI InChI=1S/C36H30O4/c37-33(21-19-25-11-3-1-4-12-25)39-23-31-32(24-40-34(38)22-20-26-13-5-2-6-14-26)36-29-17-9-7-15-27(29)35(31)28-16-8-10-18-30(28)36/h1-22,31-32,35-36H,23-24H2/b21-19+,22-20+/t31-,32-,35-,36+/m1/s1
InChIKey MLCNVKYBXIKIEE-JUQAWFJDSA-N
Mol Weight 526.6 g/mol
Molecular Formula C36H30O4
Exact Mass 526.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FIzRjM0sSo
Name (11R,12R)-9,10-dihydro-9,10-ethanoanthracene-11,12-dimethyl bis((E)-3-phenylpropenoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30O4
InChI InChI=1S/C36H30O4/c37-33(21-19-25-11-3-1-4-12-25)39-23-31-32(24-40-34(38)22-20-26-13-5-2-6-14-26)36-29-17-9-7-15-27(29)35(31)28-16-8-10-18-30(28)36/h1-22,31-32,35-36H,23-24H2/b21-19+,22-20+/t31-,32-,35-,36+/m1/s1
InChIKey MLCNVKYBXIKIEE-JUQAWFJDSA-N
Molecular Weight 526.632 g/mol
SMILES [C@]12([C@@]([C@@](COC(\C=C\c3ccccc3)=O)([C@@](c3c1cccc3)(c1c2cccc1)[H])[H])(COC(\C=C\c1ccccc1)=O)[H])[H]
SPLASH splash10-0059-1911000000-cb335fc9e95d373d4e6f
Source of Spectrum QC-22-44-14
Wiley ID 1688566