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N,N'-Dicyclohexyl-1,7-dibromoperylene-3,4:9,10-tetracarboxylic acid bisimide
SpectraBase Compound ID B0tgnNdb06d
InChI InChI=1S/C36H28Br2N2O4/c37-25-15-23-27-21(33(41)39(35(23)43)17-7-3-1-4-8-17)13-11-19-30-26(38)16-24-28-22(14-12-20(32(28)30)29(25)31(19)27)34(42)40(36(24)44)18-9-5-2-6-10-18/h11-18H,1-10H2
InChIKey QWGUIPYQMTXPRQ-UHFFFAOYSA-N
Mol Weight 712.4 g/mol
Molecular Formula C36H28Br2N2O4
Exact Mass 710.041583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdeKhM0QN5X
Name N,N'-Dicyclohexyl-1,7-dibromoperylene-3,4:9,10-tetracarboxylic acid bisimide
Comments Less than 3 mono-isotopic peaks
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Formula C36H28Br2N2O4
InChI InChI=1S/C36H28Br2N2O4/c37-25-15-23-27-21(33(41)39(35(23)43)17-7-3-1-4-8-17)13-11-19-30-26(38)16-24-28-22(14-12-20(32(28)30)29(25)31(19)27)34(42)40(36(24)44)18-9-5-2-6-10-18/h11-18H,1-10H2
InChIKey QWGUIPYQMTXPRQ-UHFFFAOYSA-N
Molecular Weight 712.438 g/mol
SMILES C1(N(C(c2c3c4c(c(cc13)Br)c1ccc3c5c1c(c4cc2)c(cc5C(N(C3=O)C1CCCCC1)=O)Br)=O)C1CCCCC1)=O
SPLASH splash10-03di-0000000900-547e985aafa85e8ca2d3
Source of Spectrum F-69-7937-3
Synonyms 5,12-dibromo-2,9-dicyclohexylisoquino[6',5',4':10,5,6]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone
Wiley ID 1595827