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Benzocyclooctene, 7,8-dihydro-1,2,3,4-tetraphenyl-
SpectraBase Compound ID LEyLxc4dj91
InChI InChI=1S/C36H28/c1-2-16-26-32-31(25-15-1)33(27-17-7-3-8-18-27)35(29-21-11-5-12-22-29)36(30-23-13-6-14-24-30)34(32)28-19-9-4-10-20-28/h3-26H,1-2H2/b25-15-,26-16-
InChIKey PPNCITLVKCSOEW-YXHOTNNGSA-N
Mol Weight 460.6 g/mol
Molecular Formula C36H28
Exact Mass 460.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eo2OGllHmye
Name Benzocyclooctene, 7,8-dihydro-1,2,3,4-tetraphenyl-
Alternate Name(s) 1,2,3,4-Tetraphenyl-7,8-dihydrobenzo[a]cyclooctene (5Z,9Z)-1,2,3,4-tetraphenyl-7,8-dihydrobenzocyclooctene (5Z,9Z)-1,2,3,4-tetraphenyl-7,8-dihydrobenzo[8]annulene
CAS Registry Number 68344-47-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H28
InChI InChI=1S/C36H28/c1-2-16-26-32-31(25-15-1)33(27-17-7-3-8-18-27)35(29-21-11-5-12-22-29)36(30-23-13-6-14-24-30)34(32)28-19-9-4-10-20-28/h3-26H,1-2H2/b25-15-,26-16-
InChIKey PPNCITLVKCSOEW-YXHOTNNGSA-N
Molecular Weight 460.620 g/mol
SMILES c1ccc(-c2c3c(c(c(c2-c2ccccc2)-c2ccccc2)-c2ccccc2)\C=C/CC\C=C/3)cc1
SPLASH splash10-01q9-6226900000-9ba134afac640c619a34
Wiley ID 1499674