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7-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-methylphenyl)heptanamide
SpectraBase Compound ID 7qLGy4eKpd4
InChI InChI=1S/C22H24N2O3/c1-16-10-5-8-13-19(16)23-20(25)14-4-2-3-9-15-24-21(26)17-11-6-7-12-18(17)22(24)27/h5-8,10-13H,2-4,9,14-15H2,1H3,(H,23,25)
InChIKey UJFDAYHVQAYDNA-UHFFFAOYSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNrcpFVkr0E
Name 7-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(2-methylphenyl)heptanamide
Comments Computed using HOSE algorithm
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Exact Mass 364.178692638 u
Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c1-16-10-5-8-13-19(16)23-20(25)14-4-2-3-9-15-24-21(26)17-11-6-7-12-18(17)22(24)27/h5-8,10-13H,2-4,9,14-15H2,1H3,(H,23,25)
InChIKey UJFDAYHVQAYDNA-UHFFFAOYSA-N
Molecular Weight 364.445 g/mol
SMILES N(C(CCCCCCN1C(C2=CC=CC=C2C1=O)=O)=O)C1=C(C)C=CC=C1