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Phthalic acid, monoamide, N-ethyl-N-phenyl-, nonyl ester
SpectraBase Compound ID 6zM4hMJFQLH
InChI InChI=1S/C25H33NO3/c1-3-5-6-7-8-9-15-20-29-25(28)23-19-14-13-18-22(23)24(27)26(4-2)21-16-11-10-12-17-21/h10-14,16-19H,3-9,15,20H2,1-2H3
InChIKey SSSIHGDYWIQDSM-UHFFFAOYSA-N
Mol Weight 395.5 g/mol
Molecular Formula C25H33NO3
Exact Mass 395.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 15CQa74S94E
Name Phthalic acid, monoamide, N-ethyl-N-phenyl-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 395.246043924 u
Formula C25H33NO3
InChI InChI=1S/C25H33NO3/c1-3-5-6-7-8-9-15-20-29-25(28)23-19-14-13-18-22(23)24(27)26(4-2)21-16-11-10-12-17-21/h10-14,16-19H,3-9,15,20H2,1-2H3
InChIKey SSSIHGDYWIQDSM-UHFFFAOYSA-N
Molecular Weight 395.543 g/mol
SMILES C1(=C(C=CC=C1)C(OCCCCCCCCC)=O)C(=O)N(CC)C1=CC=CC=C1