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1,3-Bis[(1-azulenyl)(4-hydroxyphenyl)methyl]azulene
SpectraBase Compound ID 8h9xs4al3Q
InChI InChI=1S/C44H32O2/c45-33-22-16-31(17-23-33)43(39-26-20-29-10-4-1-6-12-35(29)39)41-28-42(38-15-9-3-8-14-37(38)41)44(32-18-24-34(46)25-19-32)40-27-21-30-11-5-2-7-13-36(30)40/h1-28,43-46H
InChIKey VJZIUJUUJIKVRU-UHFFFAOYSA-N
Mol Weight 592.7 g/mol
Molecular Formula C44H32O2
Exact Mass 592.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L51vV5FCgui
Name 1,3-Bis[(1-azulenyl)(4-hydroxyphenyl)methyl]azulene
Alternate Name(s) 4-(1-azulenyl{3-[1-azulenyl(4-hydroxyphenyl)methyl]-1-azulenyl}methyl)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H32O2
InChI InChI=1S/C44H32O2/c45-33-22-16-31(17-23-33)43(39-26-20-29-10-4-1-6-12-35(29)39)41-28-42(38-15-9-3-8-14-37(38)41)44(32-18-24-34(46)25-19-32)40-27-21-30-11-5-2-7-13-36(30)40/h1-28,43-46H
InChIKey VJZIUJUUJIKVRU-UHFFFAOYSA-N
Molecular Weight 592.738 g/mol
SMILES Oc1ccc(C(c2c3c(c(C(c4ccc(cc4)O)c4c5c(ccccc5)cc4)c2)ccccc3)c2c3c(ccccc3)cc2)cc1
SPLASH splash10-004i-0902000000-0d72232bd0e577877f07
Source of Spectrum J-62-2428-9
Wiley ID 1409559