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1,5-bis(4-butylanilino)-9,10-anthraquinone
SpectraBase Compound ID CA5TiynYxqQ
InChI InChI=1S/C34H34N2O2/c1-3-5-9-23-15-19-25(20-16-23)35-29-13-7-11-27-31(29)33(37)28-12-8-14-30(32(28)34(27)38)36-26-21-17-24(18-22-26)10-6-4-2/h7-8,11-22,35-36H,3-6,9-10H2,1-2H3
InChIKey GRXYPNCZCDBAOC-UHFFFAOYSA-N
Mol Weight 502.7 g/mol
Molecular Formula C34H34N2O2
Exact Mass 502.262028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Rgh3P9zFC7
Name 1,5-bis(4-butylanilino)-9,10-anthraquinone
Alternate Name(s) 1,5-bis(4-butylanilino)anthracene-9,10-dione 1,5-bis[(4-butylphenyl)amino]anthracene-9,10-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H34N2O2
InChI InChI=1S/C34H34N2O2/c1-3-5-9-23-15-19-25(20-16-23)35-29-13-7-11-27-31(29)33(37)28-12-8-14-30(32(28)34(27)38)36-26-21-17-24(18-22-26)10-6-4-2/h7-8,11-22,35-36H,3-6,9-10H2,1-2H3
InChIKey GRXYPNCZCDBAOC-UHFFFAOYSA-N
Molecular Weight 502.658 g/mol
SMILES N(c1c2c(C(c3c(cccc3C2=O)Nc2ccc(cc2)CCCC)=O)ccc1)c1ccc(cc1)CCCC
SPLASH splash10-0zfr-0030590000-8cf1734f2ed3f4dcbfb3
Source of Spectrum IC-1233-0-0
Wiley ID 1399349