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5,28:8,11:14,19:22,25-Tetraethenodibenzo[a,m]cyclotetracosene
SpectraBase Compound ID B7NA1Zs9M14
InChI InChI=1S/C40H28/c1-5-33-25-21-29-13-15-31(16-14-29)23-27-35-7-3-12-40-36(8-4-11-39(35)40)28-24-32-19-17-30(18-20-32)22-26-34-6-2-10-38(33)37(34)9-1/h1-28H/b25-21-,26-22-,27-23-,28-24+,29-21-,30-22-,31-23-,32-24-,33-25-,34-26+,35-27+,36-28+
InChIKey FWRYWUBDYVVMIH-MAWJGWQMSA-N
Mol Weight 508.7 g/mol
Molecular Formula C40H28
Exact Mass 508.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsvhdgRg0ZM
Name 5,28:8,11:14,19:22,25-Tetraethenodibenzo[a,m]cyclotetracosene
Alternate Name(s) Heptacyclo[32.2.2.2(16,19).0(4,9).0(8,13).0(22,27).0(26,31)]tetraconta-1(36),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,37,39-icosaene [2](1,5)naphthaleno[2]paracyclo[2](1,5)-naphthaleno[2]paracyclophanetetraene
CAS Registry Number 72862-23-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H28
InChI InChI=1S/C40H28/c1-5-33-25-21-29-13-15-31(16-14-29)23-27-35-7-3-12-40-36(8-4-11-39(35)40)28-24-32-19-17-30(18-20-32)22-26-34-6-2-10-38(33)37(34)9-1/h1-28H/b25-21-,26-22-,27-23-,28-24+,29-21-,30-22-,31-23-,32-24-,33-25-,34-26+,35-27+,36-28+
InChIKey FWRYWUBDYVVMIH-MAWJGWQMSA-N
Molecular Weight 508.664 g/mol
SMILES c12c3c(\C=C\c4ccc(\C=C/c5cccc6c5cccc6\C=C/c5ccc(\C=C/c1ccc3)cc5)cc4)ccc2
SPLASH splash10-0a4i-0000090000-7936f4f4b89be0a5ab09
Source of Spectrum SB-33-447-0
Wiley ID 1400305