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3,4,5-Trimethoxy-N-(2-oxo-1-pentylazepan-3-yl)benzamide

View entire compound with spectra: 1 NMR, and 1 FTIR

3,4,5-Trimethoxy-N-(2-oxo-1-pentylazepan-3-yl)benzamide
SpectraBase Compound ID KDQd2sFWc2C
InChI InChI=1S/C21H32N2O5/c1-5-6-8-11-23-12-9-7-10-16(21(23)25)22-20(24)15-13-17(26-2)19(28-4)18(14-15)27-3/h13-14,16H,5-12H2,1-4H3,(H,22,24)
InChIKey CAAAGYKMOLITPN-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C21H32N2O5
Exact Mass 392.231122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1kBi6I1lmT
Name 3,4,5-Trimethoxy-N-(2-oxo-1-pentylazepan-3-yl)benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.231122133 u
Formula C21H32N2O5
InChI InChI=1S/C21H32N2O5/c1-5-6-8-11-23-12-9-7-10-16(21(23)25)22-20(24)15-13-17(26-2)19(28-4)18(14-15)27-3/h13-14,16H,5-12H2,1-4H3,(H,22,24)
InChIKey CAAAGYKMOLITPN-UHFFFAOYSA-N
Molecular Weight 392.496 g/mol
SMILES C(C1=CC(=C(C(=C1)OC)OC)OC)(=O)NC1C(N(CCCC1)CCCCC)=O