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1-[6-(3,6,7,10,11-pentaheptoxytriphenylen-2-yl)oxyhexoxy]-9,10-anthraquinone
SpectraBase Compound ID 9fHGW9Ukp19
InChI InChI=1S/C73H100O9/c1-6-11-16-21-30-43-77-65-49-58-59-50-66(78-44-31-22-17-12-7-2)68(80-46-33-24-19-14-9-4)52-61(59)63-54-70(69(81-47-34-25-20-15-10-5)53-62(63)60(58)51-67(65)79-45-32-23-18-13-8-3)82-48-36-27-26-35-42-76-64-41-37-40-57-71(64)73(75)56-39-29-28-38-55(56)72(57)74/h28-29,37-41,49-54H,6-27,30-36,42-48H2,1-5H3
InChIKey QENVWKNTSIAZJQ-UHFFFAOYSA-N
Mol Weight 1121.6 g/mol
Molecular Formula C73H100O9
Exact Mass 1120.736735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxdGtWKfCgg
Name 1-[6-(3,6,7,10,11-pentaheptoxytriphenylen-2-yl)oxyhexoxy]-9,10-anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C73H100O9
InChI InChI=1S/C73H100O9/c1-6-11-16-21-30-43-77-65-49-58-59-50-66(78-44-31-22-17-12-7-2)68(80-46-33-24-19-14-9-4)52-61(59)63-54-70(69(81-47-34-25-20-15-10-5)53-62(63)60(58)51-67(65)79-45-32-23-18-13-8-3)82-48-36-27-26-35-42-76-64-41-37-40-57-71(64)73(75)56-39-29-28-38-55(56)72(57)74/h28-29,37-41,49-54H,6-27,30-36,42-48H2,1-5H3
InChIKey QENVWKNTSIAZJQ-UHFFFAOYSA-N
Molecular Weight 1121.594 g/mol
SMILES C1(c2c(cccc2OCCCCCCOc2cc3c4c(cc(c(c4)OCCCCCCC)OCCCCCCC)c4c(c3cc2OCCCCCCC)cc(c(OCCCCCCC)c4)OCCCCCCC)C(c2c1cccc2)=O)=O
SPLASH splash10-00di-0921010031-50eca48cd612186f1685
Source of Spectrum KC-0-3359-1
Synonyms 1-[6-(3,6,7,10,11-pentaheptoxytriphenylen-2-yl)oxyhexoxy]anthracene-9,10-dione 1-[6-[(3,6,7,10,11-pentaheptoxy-2-triphenylenyl)oxy]hexoxy]anthracene-9,10-dione
Wiley ID 831799