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(11R,12R)-9,10-dihydro-9,10-ethanoanthracene-11,12-dimethyl bis((E)-2,3-diphenyl-2-propenoate)
SpectraBase Compound ID IgR1KLMqxwx
InChI InChI=1S/C48H38O4/c49-47(41(35-21-9-3-10-22-35)29-33-17-5-1-6-18-33)51-31-43-44(46-39-27-15-13-25-37(39)45(43)38-26-14-16-28-40(38)46)32-52-48(50)42(36-23-11-4-12-24-36)30-34-19-7-2-8-20-34/h1-30,43-46H,31-32H2/b41-29+,42-30+/t43-,44-,45-,46+/m1/s1
InChIKey UKADLYSNLYBJFA-OHFFMQCPSA-N
Mol Weight 678.8 g/mol
Molecular Formula C48H38O4
Exact Mass 678.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gn2NNqLaRYd
Name (11R,12R)-9,10-dihydro-9,10-ethanoanthracene-11,12-dimethyl bis((E)-2,3-diphenyl-2-propenoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H38O4
InChI InChI=1S/C48H38O4/c49-47(41(35-21-9-3-10-22-35)29-33-17-5-1-6-18-33)51-31-43-44(46-39-27-15-13-25-37(39)45(43)38-26-14-16-28-40(38)46)32-52-48(50)42(36-23-11-4-12-24-36)30-34-19-7-2-8-20-34/h1-30,43-46H,31-32H2/b41-29+,42-30+/t43-,44-,45-,46+/m1/s1
InChIKey UKADLYSNLYBJFA-OHFFMQCPSA-N
Molecular Weight 678.828 g/mol
SMILES [C@]12([C@@]([C@]([C@](c3c2cccc3)(c2c1cccc2)[H])(COC(\C(=C\c1ccccc1)c1ccccc1)=O)[H])(COC(\C(=C\c1ccccc1)c1ccccc1)=O)[H])[H]
SPLASH splash10-0ke9-1390000000-0fa194290aa33e3ad9a5
Source of Spectrum QC-22-45-18
Wiley ID 1688563