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1-[6-(3,6,7,10,11-pentakis-decoxytriphenylen-2-yl)oxyhexoxy]-9,10-anthraquinone
SpectraBase Compound ID 1M0muQqttud
InChI InChI=1S/C88H130O9/c1-6-11-16-21-26-31-36-45-58-92-80-64-73-74-65-81(93-59-46-37-32-27-22-17-12-7-2)83(95-61-48-39-34-29-24-19-14-9-4)67-76(74)78-69-85(97-63-51-42-41-50-57-91-79-56-52-55-72-86(79)88(90)71-54-44-43-53-70(71)87(72)89)84(96-62-49-40-35-30-25-20-15-10-5)68-77(78)75(73)66-82(80)94-60-47-38-33-28-23-18-13-8-3/h43-44,52-56,64-69H,6-42,45-51,57-63H2,1-5H3
InChIKey KYDOOTPUXLUYSH-UHFFFAOYSA-N
Mol Weight 1332.0 g/mol
Molecular Formula C88H130O9
Exact Mass 1330.971486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ftOZkgKBl1
Name 1-[6-(3,6,7,10,11-pentakis-decoxytriphenylen-2-yl)oxyhexoxy]-9,10-anthraquinone
Alternate Name(s) 1-[6-(3,6,7,10,11-pentakis-decoxytriphenylen-2-yl)oxyhexoxy]anthracene-9,10-dione 1-[6-[(3,6,7,10,11-pentakis-decoxy-2-triphenylenyl)oxy]hexoxy]anthracene-9,10-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C88H130O9
InChI InChI=1S/C88H130O9/c1-6-11-16-21-26-31-36-45-58-92-80-64-73-74-65-81(93-59-46-37-32-27-22-17-12-7-2)83(95-61-48-39-34-29-24-19-14-9-4)67-76(74)78-69-85(97-63-51-42-41-50-57-91-79-56-52-55-72-86(79)88(90)71-54-44-43-53-70(71)87(72)89)84(96-62-49-40-35-30-25-20-15-10-5)68-77(78)75(73)66-82(80)94-60-47-38-33-28-23-18-13-8-3/h43-44,52-56,64-69H,6-42,45-51,57-63H2,1-5H3
InChIKey KYDOOTPUXLUYSH-UHFFFAOYSA-N
Molecular Weight 1331.999 g/mol
SMILES C1(c2c(cccc2OCCCCCCOc2cc3c4c(cc(c(c4)OCCCCCCCCCC)OCCCCCCCCCC)c4c(c3cc2OCCCCCCCCCC)cc(c(OCCCCCCCCCC)c4)OCCCCCCCCCC)C(c2c1cccc2)=O)=O
SPLASH splash10-00e9-0259000000-c0bef6aeeedb08378c89
Source of Spectrum KC-0-3360-1
Wiley ID 831796