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Phthalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, octyl ester

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Phthalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, octyl ester
SpectraBase Compound ID JdwggEL7LYE
InChI InChI=1S/C25H33NO3/c1-4-6-7-8-9-12-18-29-25(28)23-17-11-10-16-22(23)24(27)26(5-2)21-15-13-14-20(3)19-21/h10-11,13-17,19H,4-9,12,18H2,1-3H3
InChIKey VFYSVMAWAVBRLZ-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 GyXBaQ8zDgk
Name Phthalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 395.246043924 u
Formula C25H33NO3
InChI InChI=1S/C25H33NO3/c1-4-6-7-8-9-12-18-29-25(28)23-17-11-10-16-22(23)24(27)26(5-2)21-15-13-14-20(3)19-21/h10-11,13-17,19H,4-9,12,18H2,1-3H3
InChIKey VFYSVMAWAVBRLZ-UHFFFAOYSA-N
Molecular Weight 395.543 g/mol
SMILES C(C1=CC=CC=C1C(OCCCCCCCC)=O)(N(CC)C1=CC(=CC=C1)C)=O