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1,4-Bis[bis(3-methyl-1-azulenyl)methyl]benzene
SpectraBase Compound ID 2eRf8RPXrT9
InChI InChI=1S/C52H42/c1-33-29-47(43-21-13-5-9-17-39(33)43)51(48-30-34(2)40-18-10-6-14-22-44(40)48)37-25-27-38(28-26-37)52(49-31-35(3)41-19-11-7-15-23-45(41)49)50-32-36(4)42-20-12-8-16-24-46(42)50/h5-32,51-52H,1-4H3
InChIKey CTGPGIHBDILEQR-UHFFFAOYSA-N
Mol Weight 666.9 g/mol
Molecular Formula C52H42
Exact Mass 666.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kfcdSb6KF
Name 1,4-Bis[bis(3-methyl-1-azulenyl)methyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C52H42
InChI InChI=1S/C52H42/c1-33-29-47(43-21-13-5-9-17-39(33)43)51(48-30-34(2)40-18-10-6-14-22-44(40)48)37-25-27-38(28-26-37)52(49-31-35(3)41-19-11-7-15-23-45(41)49)50-32-36(4)42-20-12-8-16-24-46(42)50/h5-32,51-52H,1-4H3
InChIKey CTGPGIHBDILEQR-UHFFFAOYSA-N
Molecular Weight 666.908 g/mol
SMILES c1(c2c(ccccc2)c(c1)C)C(c1c2c(ccccc2)c(c1)C)c1ccc(C(c2c3c(ccccc3)c(c2)C)c2c3c(ccccc3)c(c2)C)cc1
SPLASH splash10-00kf-0900107000-8452d6594c6223201dc6
Source of Spectrum AJ-73-1872-8
Synonyms 1-[{4-[bis(3-methyl-1-azulenyl)methyl]phenyl}(3-methyl-1-azulenyl)methyl]-3-methylazulene
Wiley ID 775451