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2-(1,3-diketobenzo[de]isoquinolin-2-yl)-6-[3-(dimethylamino)propylamino]benzo[de]isoquinoline-1,3-quinone
SpectraBase Compound ID G9WTx79Izpd
InChI InChI=1S/C29H24N4O4/c1-31(2)16-6-15-30-23-14-13-22-25-18(23)9-5-12-21(25)28(36)33(29(22)37)32-26(34)19-10-3-7-17-8-4-11-20(24(17)19)27(32)35/h3-5,7-14,30H,6,15-16H2,1-2H3
InChIKey KRQCKJZPCOEUOC-UHFFFAOYSA-N
Mol Weight 492.54 g/mol
Molecular Formula C29H24N4O4
Exact Mass 492.179755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KaPrxn70xT
Name 2-(1,3-diketobenzo[de]isoquinolin-2-yl)-6-[3-(dimethylamino)propylamino]benzo[de]isoquinoline-1,3-quinone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H24N4O4
InChI InChI=1S/C29H24N4O4/c1-31(2)16-6-15-30-23-14-13-22-25-18(23)9-5-12-21(25)28(36)33(29(22)37)32-26(34)19-10-3-7-17-8-4-11-20(24(17)19)27(32)35/h3-5,7-14,30H,6,15-16H2,1-2H3
InChIKey KRQCKJZPCOEUOC-UHFFFAOYSA-N
Molecular Weight 492.535 g/mol
SMILES N(c1c2c3c(C(N(N4C(c5cccc6c5c(C4=O)ccc6)=O)C(c3cc1)=O)=O)ccc2)CCCN(C)C
SPLASH splash10-0089-0000900000-061ac7a3f38cb3c2aaaa
Source of Spectrum KC-0-548-1
Synonyms 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-6-[3-(dimethylamino)propylamino]benzo[de]isoquinoline-1,3-dione 6-[3-(dimethylamino)propylamino]-2-(1,3-dioxo-2-benzo[de]isoquinolinyl)benzo[de]isoquinoline-1,3-dione 6-[3-(dimethylamino)propylamino]-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)benzo[de]isoquinoline-1,3-dione
Wiley ID 828184