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1,3-Bis[(1-azulenyl)(4-methoxyphenyl)methyl]azulene
SpectraBase Compound ID L2GNwQYT8O5
InChI InChI=1S/C46H36O2/c1-47-35-24-18-33(19-25-35)45(41-28-22-31-12-6-3-8-14-37(31)41)43-30-44(40-17-11-5-10-16-39(40)43)46(34-20-26-36(48-2)27-21-34)42-29-23-32-13-7-4-9-15-38(32)42/h3-30,45-46H,1-2H3
InChIKey CCDHQGQKYRBHET-UHFFFAOYSA-N
Mol Weight 620.8 g/mol
Molecular Formula C46H36O2
Exact Mass 620.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BoqkBRFHwjE
Name 1,3-Bis[(1-azulenyl)(4-methoxyphenyl)methyl]azulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H36O2
InChI InChI=1S/C46H36O2/c1-47-35-24-18-33(19-25-35)45(41-28-22-31-12-6-3-8-14-37(31)41)43-30-44(40-17-11-5-10-16-39(40)43)46(34-20-26-36(48-2)27-21-34)42-29-23-32-13-7-4-9-15-38(32)42/h3-30,45-46H,1-2H3
InChIKey CCDHQGQKYRBHET-UHFFFAOYSA-N
Molecular Weight 620.792 g/mol
SMILES c1(c2c(ccccc2)c(c1)C(c1c2c(ccccc2)cc1)c1ccc(cc1)OC)C(c1c2c(ccccc2)cc1)c1ccc(cc1)OC
SPLASH splash10-00vi-0004901000-5a54faf2227fc07c5ef4
Source of Spectrum AJ-72-844-17
Wiley ID 774956