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1,2,5,6-tetraphenyltricyclo[3.3.0.0(2,6)]octane
SpectraBase Compound ID Jb5uqtHloor
InChI InChI=1S/C32H28/c1-5-13-25(14-6-1)29-21-22-32(28-19-11-4-12-20-28)30(29,26-15-7-2-8-16-26)23-24-31(29,32)27-17-9-3-10-18-27/h1-20H,21-24H2/t29-,30-,31+,32+
InChIKey RWEPWXWCXDDWJN-TZLSHIEUSA-N
Mol Weight 412.6 g/mol
Molecular Formula C32H28
Exact Mass 412.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nKZrF71AeJ
Name 1,2,5,6-tetraphenyltricyclo[3.3.0.0(2,6)]octane
CAS Registry Number 119391-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28
InChI InChI=1S/C32H28/c1-5-13-25(14-6-1)29-21-22-32(28-19-11-4-12-20-28)30(29,26-15-7-2-8-16-26)23-24-31(29,32)27-17-9-3-10-18-27/h1-20H,21-24H2/t29-,30-,31+,32+
InChIKey RWEPWXWCXDDWJN-TZLSHIEUSA-N
Molecular Weight 412.576 g/mol
SMILES [C@]12([C@@]3(CC[C@]2([C@]3(c2ccccc2)CC1)c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-08fr-3045900000-a652da35ba2e9faec0a6
Source of Spectrum J-54-2057-3
Wiley ID 1374915