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2-(1-hexylheptyl)benzo[de]isoquinolin-1,3-dione
SpectraBase Compound ID 6RbNlDxsRKS
InChI InChI=1S/C25H33NO2/c1-3-5-7-9-15-20(16-10-8-6-4-2)26-24(27)21-17-11-13-19-14-12-18-22(23(19)21)25(26)28/h11-14,17-18,20H,3-10,15-16H2,1-2H3
InChIKey FDZJELDCIIYQLK-UHFFFAOYSA-N
Mol Weight 379.5 g/mol
Molecular Formula C25H33NO2
Exact Mass 379.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OGO5clcWYL
Name 2-(1-hexylheptyl)benzo[de]isoquinolin-1,3-dione
Appearance Yellow oil
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Formula C25H33NO2
InChI InChI=1S/C25H33NO2/c1-3-5-7-9-15-20(16-10-8-6-4-2)26-24(27)21-17-11-13-19-14-12-18-22(23(19)21)25(26)28/h11-14,17-18,20H,3-10,15-16H2,1-2H3
InChIKey FDZJELDCIIYQLK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type DEI positive ion
Molecular Weight 379.544 g/mol
Reported Formula C25H33NO2
SMILES c1ccc2C(=O)N(C(CCCCCC)CCCCCC)C(=O)c3c2c1ccc3
SPLASH splash10-0002-2900000000-3992b7c5c86d261e3f88
Source of Spectrum EP2925817A2
Thin-Layer Chromatography Rf = 0.85 (silica gel/chloroform)
Wiley ID 1850482