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8-(dioctylamino)quinoline-5,6-dione
SpectraBase Compound ID 3MlUwlFyeyh
InChI InChI=1S/C25H38N2O2/c1-3-5-7-9-11-13-18-27(19-14-12-10-8-6-4-2)22-20-23(28)25(29)21-16-15-17-26-24(21)22/h15-17,20H,3-14,18-19H2,1-2H3
InChIKey NREIQJMAFXYHFH-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C25H38N2O2
Exact Mass 398.293328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WDOSgngmDH
Name 8-(dioctylamino)quinoline-5,6-dione
Comments Less than 3 mono-isotopic peaks
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Formula C25H38N2O2
InChI InChI=1S/C25H38N2O2/c1-3-5-7-9-11-13-18-27(19-14-12-10-8-6-4-2)22-20-23(28)25(29)21-16-15-17-26-24(21)22/h15-17,20H,3-14,18-19H2,1-2H3
InChIKey NREIQJMAFXYHFH-UHFFFAOYSA-N
Molecular Weight 398.591 g/mol
SMILES c1nc2C(=CC(C(c2cc1)=O)=O)N(CCCCCCCC)CCCCCCCC
SPLASH splash10-000i-0093000000-89d20046f8911d4f12a4
Source of Spectrum E1-38-2842-10
Synonyms 8-(dioctylamino)quinoline-5,6-quinone
Wiley ID 1518546