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Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,10,12,16,18,22,24,25,27,29,31-tridecaene
SpectraBase Compound ID 1QTu9GavJmS
InChI InChI=1S/C32H30/c1-2-26-4-3-25(1)17-18-27-5-7-29(8-6-27)21-22-31-13-15-32(16-14-31)24-23-30-11-9-28(10-12-30)20-19-26/h1-18H,19-24H2/b18-17-
InChIKey BZCAEIRJKVXVHJ-ZCXUNETKSA-N
Mol Weight 414.6 g/mol
Molecular Formula C32H30
Exact Mass 414.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7G3t4CcGboa
Name Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,10,12,16,18,22,24,25,27,29,31-tridecaene
CAS Registry Number 71889-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H30
InChI InChI=1S/C32H30/c1-2-26-4-3-25(1)17-18-27-5-7-29(8-6-27)21-22-31-13-15-32(16-14-31)24-23-30-11-9-28(10-12-30)20-19-26/h1-18H,19-24H2/b18-17-
InChIKey BZCAEIRJKVXVHJ-ZCXUNETKSA-N
Molecular Weight 414.592 g/mol
SMILES c12\C=C/c3ccc(CCc4ccc(CCc5ccc(CCc(cc2)cc1)cc5)cc4)cc3
SPLASH splash10-0bt9-0390800000-4c520fb6a9353a773c87
Source of Spectrum SB-33-393-0
Synonyms 2,3,8,9,14,15-Hexahydro[2.2.2.2]paracyclophanetetraene Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-1(24),2,4,6,10,12,16,18,22,25,27,29,31-tridecaene [2(4)]paracyclophanemonoene
Wiley ID 1375857