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Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,8,10,12,16,18, 22,24,25,27,29,31-tetradecaene
SpectraBase Compound ID GbUm6SN29hD
InChI InChI=1S/C32H28/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/h1-20H,21-24H2/b18-17-,20-19-
InChIKey QHCNKWDWYCBJFJ-RXGVRZIVSA-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 LZtcepjYFUy
Name Pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-2,4,6,8,10,12,16,18, 22,24,25,27,29,31-tetradecaene
CAS Registry Number 71889-44-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28
InChI InChI=1S/C32H28/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/h1-20H,21-24H2/b18-17-,20-19-
InChIKey QHCNKWDWYCBJFJ-RXGVRZIVSA-N
Molecular Weight 412.576 g/mol
SMILES c12\C=C/c3ccc(CCc4ccc(CCc5ccc(\C=C/c(cc2)cc1)cc5)cc4)cc3
SPLASH splash10-03di-0010900000-1a827c158a7eb055acce
Source of Spectrum SB-33-393-0
Synonyms pentacyclo[20.2.2.2(4,7).2(10,13).2(16,19)]dotriaconta-1(24),2,4,6,8,10,12,16,18,22,25,27,29,31-tetradecaene [2(4)]paracyclophane-1,9-diene
Wiley ID 1374911