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Phthalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, heptyl ester
SpectraBase Compound ID G7zaAS2DxVC
InChI InChI=1S/C24H31NO3/c1-4-6-7-8-11-17-28-24(27)22-16-10-9-15-21(22)23(26)25(5-2)20-14-12-13-19(3)18-20/h9-10,12-16,18H,4-8,11,17H2,1-3H3
InChIKey FCNSUIUYYGZUPH-UHFFFAOYSA-N
Mol Weight 381.52 g/mol
Molecular Formula C24H31NO3
Exact Mass 381.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vn5K53RCUF
Name Phthalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 381.230393859 u
Formula C24H31NO3
InChI InChI=1S/C24H31NO3/c1-4-6-7-8-11-17-28-24(27)22-16-10-9-15-21(22)23(26)25(5-2)20-14-12-13-19(3)18-20/h9-10,12-16,18H,4-8,11,17H2,1-3H3
InChIKey FCNSUIUYYGZUPH-UHFFFAOYSA-N
Molecular Weight 381.516 g/mol
SMILES C1(=CC=CC=C1C(OCCCCCCC)=O)C(N(CC)C1=CC(=CC=C1)C)=O