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3-(Dodecylamino)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID 2VVtTsS43Wu
InChI InChI=1S/C24H38N2O3/c1-3-5-6-7-8-9-10-11-12-13-18-25-22-19-23(27)26(24(22)28)20-14-16-21(17-15-20)29-4-2/h14-17,22,25H,3-13,18-19H2,1-2H3
InChIKey MZRMKRVONPBPNY-UHFFFAOYSA-N
Mol Weight 402.6 g/mol
Molecular Formula C24H38N2O3
Exact Mass 402.288243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bl2Bi6Wsggp
Name 3-(Dodecylamino)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
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Exact Mass 402.288243089 u
Formula C24H38N2O3
InChI InChI=1S/C24H38N2O3/c1-3-5-6-7-8-9-10-11-12-13-18-25-22-19-23(27)26(24(22)28)20-14-16-21(17-15-20)29-4-2/h14-17,22,25H,3-13,18-19H2,1-2H3
InChIKey MZRMKRVONPBPNY-UHFFFAOYSA-N
Molecular Weight 402.579 g/mol
SMILES N(C1C(N(C(C1)=O)C1=CC=C(C=C1)OCC)=O)CCCCCCCCCCCC