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Diethyl 5-[(4-propoxybenzoyl)amino]isophthalate

View entire compound with spectra: 2 NMR

Diethyl 5-[(4-propoxybenzoyl)amino]isophthalate
SpectraBase Compound ID AagaE8rkKZs
InChI InChI=1S/C22H25NO6/c1-4-11-29-19-9-7-15(8-10-19)20(24)23-18-13-16(21(25)27-5-2)12-17(14-18)22(26)28-6-3/h7-10,12-14H,4-6,11H2,1-3H3,(H,23,24)
InChIKey LAABRBMDQFBZGV-UHFFFAOYSA-N
Mol Weight 399.44 g/mol
Molecular Formula C22H25NO6
Exact Mass 399.168188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K79er34c33R
Name Diethyl 5-[(4-propoxybenzoyl)amino]isophthalate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.168187523 u
Formula C22H25NO6
InChI InChI=1S/C22H25NO6/c1-4-11-29-19-9-7-15(8-10-19)20(24)23-18-13-16(21(25)27-5-2)12-17(14-18)22(26)28-6-3/h7-10,12-14H,4-6,11H2,1-3H3,(H,23,24)
InChIKey LAABRBMDQFBZGV-UHFFFAOYSA-N
Molecular Weight 399.443 g/mol
SMILES N(C(C1=CC=C(C=C1)OCCC)=O)C1=CC(C(=O)OCC)=CC(=C1)C(=O)OCC