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Phthalic acid, monoamide, N-ethyl-N-phenyl-, dodecyl ester

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Phthalic acid, monoamide, N-ethyl-N-phenyl-, dodecyl ester
SpectraBase Compound ID J7zW4jm3wIA
InChI InChI=1S/C28H39NO3/c1-3-5-6-7-8-9-10-11-12-18-23-32-28(31)26-22-17-16-21-25(26)27(30)29(4-2)24-19-14-13-15-20-24/h13-17,19-22H,3-12,18,23H2,1-2H3
InChIKey VKAQVYWYBDSQHO-UHFFFAOYSA-N
Mol Weight 437.6 g/mol
Molecular Formula C28H39NO3
Exact Mass 437.292994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I6xWc7Bxi26
Name Phthalic acid, monoamide, N-ethyl-N-phenyl-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 437.292994117 u
Formula C28H39NO3
InChI InChI=1S/C28H39NO3/c1-3-5-6-7-8-9-10-11-12-18-23-32-28(31)26-22-17-16-21-25(26)27(30)29(4-2)24-19-14-13-15-20-24/h13-17,19-22H,3-12,18,23H2,1-2H3
InChIKey VKAQVYWYBDSQHO-UHFFFAOYSA-N
Molecular Weight 437.624 g/mol
SMILES C1(=C(C=CC=C1)C(OCCCCCCCCCCCC)=O)C(=O)N(CC)C1=CC=CC=C1