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2-benzofurancarboxamide, N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]-
SpectraBase Compound ID FZ7Zg0dbIei
InChI InChI=1S/C21H22N2O6/c1-26-16-11-14(12-17(27-2)19(16)28-3)20(24)22-8-9-23-21(25)18-10-13-6-4-5-7-15(13)29-18/h4-7,10-12H,8-9H2,1-3H3,(H,22,24)(H,23,25)
InChIKey CBDLKEKSTIRFLU-UHFFFAOYSA-N
Mol Weight 398.42 g/mol
Molecular Formula C21H22N2O6
Exact Mass 398.147786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eoov0Qu6wfX
Name 2-Benzofurancarboxamide, N-[2-[(3,4,5-trimethoxybenzoyl)amino]ethyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.147786430 u
Formula C21H22N2O6
InChI InChI=1S/C21H22N2O6/c1-26-16-11-14(12-17(27-2)19(16)28-3)20(24)22-8-9-23-21(25)18-10-13-6-4-5-7-15(13)29-18/h4-7,10-12H,8-9H2,1-3H3,(H,22,24)(H,23,25)
InChIKey CBDLKEKSTIRFLU-UHFFFAOYSA-N
Molecular Weight 398.415 g/mol
SMILES N(C(C=1OC2=CC=CC=C2C1)=O)CCNC(C1=CC(OC)=C(C(=C1)OC)OC)=O