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Adipic acid, monoamide, N-ethyl-N-phenyl-, heptyl ester

View entire compound with spectra: 1 NMR

Adipic acid, monoamide, N-ethyl-N-phenyl-, heptyl ester
SpectraBase Compound ID 9hf2yKOO7r6
InChI InChI=1S/C21H33NO3/c1-3-5-6-7-13-18-25-21(24)17-12-11-16-20(23)22(4-2)19-14-9-8-10-15-19/h8-10,14-15H,3-7,11-13,16-18H2,1-2H3
InChIKey OZTFTKNWLMAOHI-UHFFFAOYSA-N
Mol Weight 347.5 g/mol
Molecular Formula C21H33NO3
Exact Mass 347.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7uQvYGqNlf
Name Adipic acid, monoamide, N-ethyl-N-phenyl-, heptyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.246043924 u
Formula C21H33NO3
InChI InChI=1S/C21H33NO3/c1-3-5-6-7-13-18-25-21(24)17-12-11-16-20(23)22(4-2)19-14-9-8-10-15-19/h8-10,14-15H,3-7,11-13,16-18H2,1-2H3
InChIKey OZTFTKNWLMAOHI-UHFFFAOYSA-N
Molecular Weight 347.499 g/mol
SMILES C(CC(=O)N(CC)C1=CC=CC=C1)CCC(OCCCCCCC)=O