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Terephthalic acid, monoamide, N-(2-ethylphenyl)-, ethyl ester

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Terephthalic acid, monoamide, N-(2-ethylphenyl)-, ethyl ester
SpectraBase Compound ID 9eqHgXTxt1W
InChI InChI=1S/C18H19NO3/c1-3-13-7-5-6-8-16(13)19-17(20)14-9-11-15(12-10-14)18(21)22-4-2/h5-12H,3-4H2,1-2H3,(H,19,20)
InChIKey WHSBKDWQAPPWIH-UHFFFAOYSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67tQL98hE5F
Name Terephthalic acid, monoamide, N-(2-ethylphenyl)-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 297.136493473 u
Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-3-13-7-5-6-8-16(13)19-17(20)14-9-11-15(12-10-14)18(21)22-4-2/h5-12H,3-4H2,1-2H3,(H,19,20)
InChIKey WHSBKDWQAPPWIH-UHFFFAOYSA-N
Molecular Weight 297.354 g/mol
SMILES C(OC(=O)C1=CC=C(C=C1)C(=O)NC1=C(CC)C=CC=C1)C