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Terephthalic acid, monoamide, N-ethyl-N-phenyl-, isobutyl ester

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Terephthalic acid, monoamide, N-ethyl-N-phenyl-, isobutyl ester
SpectraBase Compound ID 76sEyioO34p
InChI InChI=1S/C20H23NO3/c1-4-21(18-8-6-5-7-9-18)19(22)16-10-12-17(13-11-16)20(23)24-14-15(2)3/h5-13,15H,4,14H2,1-3H3
InChIKey QXMSOWRFAPMQAF-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XG0E9kF2YN
Name Terephthalic acid, monoamide, N-ethyl-N-phenyl-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 325.167793602 u
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-4-21(18-8-6-5-7-9-18)19(22)16-10-12-17(13-11-16)20(23)24-14-15(2)3/h5-13,15H,4,14H2,1-3H3
InChIKey QXMSOWRFAPMQAF-UHFFFAOYSA-N
Molecular Weight 325.408 g/mol
SMILES C1(=CC=CC=C1)N(CC)C(=O)C1=CC=C(C=C1)C(=O)OCC(C)C