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3-Benzyl-3-butylamino-1-phenyl-1H,3H-quinoline-2,4-dione
SpectraBase Compound ID 5jmR7sYL6VK
InChI InChI=1S/C26H26N2O2/c1-2-3-18-27-26(19-20-12-6-4-7-13-20)24(29)22-16-10-11-17-23(22)28(25(26)30)21-14-8-5-9-15-21/h4-17,27H,2-3,18-19H2,1H3
InChIKey HPLDNYOFLMXQAZ-UHFFFAOYSA-N
Mol Weight 398.51 g/mol
Molecular Formula C26H26N2O2
Exact Mass 398.199428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DR3Lrdb1GFI
Name 3-Benzyl-3-butylamino-1-phenyl-1H,3H-quinoline-2,4-dione
Comments Computed using HOSE algorithm
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Exact Mass 398.199428083 u
Formula C26H26N2O2
InChI InChI=1S/C26H26N2O2/c1-2-3-18-27-26(19-20-12-6-4-7-13-20)24(29)22-16-10-11-17-23(22)28(25(26)30)21-14-8-5-9-15-21/h4-17,27H,2-3,18-19H2,1H3
InChIKey HPLDNYOFLMXQAZ-UHFFFAOYSA-N
Molecular Weight 398.506 g/mol
SMILES C1(C(N(C=2C=CC=CC2)C2=C(C1=O)C=CC=C2)=O)(CC=1C=CC=CC1)NCCCC