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(p)-N,N,N',N'-Tetrahexyl-1,12-dimethylbenzo[c]phenanthrene-5,8-diamide
SpectraBase Compound ID 6dzBhTzAYby
InChI InChI=1S/C46H66N2O2/c1-7-11-15-19-29-47(30-20-16-12-8-2)45(49)40-33-37-34-41(46(50)48(31-21-17-13-9-3)32-22-18-14-10-4)39-28-24-26-36(6)43(39)44(37)42-35(5)25-23-27-38(40)42/h23-28,33-34H,7-22,29-32H2,1-6H3
InChIKey QPCYIKYXAZAZKS-UHFFFAOYSA-N
Mol Weight 679.0 g/mol
Molecular Formula C46H66N2O2
Exact Mass 678.512429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dN72dcmX3Y
Name (p)-N,N,N',N'-Tetrahexyl-1,12-dimethylbenzo[c]phenanthrene-5,8-diamide
Comments Less than 3 mono-isotopic peaks
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Formula C46H66N2O2
InChI InChI=1S/C46H66N2O2/c1-7-11-15-19-29-47(30-20-16-12-8-2)45(49)40-33-37-34-41(46(50)48(31-21-17-13-9-3)32-22-18-14-10-4)39-28-24-26-36(6)43(39)44(37)42-35(5)25-23-27-38(40)42/h23-28,33-34H,7-22,29-32H2,1-6H3
InChIKey QPCYIKYXAZAZKS-UHFFFAOYSA-N
Molecular Weight 679.046 g/mol
SMILES c1(c2c(c(C)ccc2)c2c(c1)cc(c1cccc(c21)C)C(N(CCCCCC)CCCCCC)=O)C(N(CCCCCC)CCCCCC)=O
SPLASH splash10-004i-0000309000-e8652643f11a7374b0fd
Source of Spectrum F-55-14862-9
Wiley ID 840272