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N-(1-Isopropyl-2-oxoazepan-3-yl)-3,4,5-trimethoxybenzamide
SpectraBase Compound ID laKFfvFC9Q
InChI InChI=1S/C19H28N2O5/c1-12(2)21-9-7-6-8-14(19(21)23)20-18(22)13-10-15(24-3)17(26-5)16(11-13)25-4/h10-12,14H,6-9H2,1-5H3,(H,20,22)
InChIKey JLJHCVMWXWDZCL-UHFFFAOYSA-N
Mol Weight 364.44 g/mol
Molecular Formula C19H28N2O5
Exact Mass 364.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyebxqycTYo
Name N-(1-Isopropyl-2-oxoazepan-3-yl)-3,4,5-trimethoxybenzamide
Comments Computed using HOSE algorithm
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Exact Mass 364.199822005 u
Formula C19H28N2O5
InChI InChI=1S/C19H28N2O5/c1-12(2)21-9-7-6-8-14(19(21)23)20-18(22)13-10-15(24-3)17(26-5)16(11-13)25-4/h10-12,14H,6-9H2,1-5H3,(H,20,22)
InChIKey JLJHCVMWXWDZCL-UHFFFAOYSA-N
Molecular Weight 364.442 g/mol
SMILES C(C1=CC(=C(C(=C1)OC)OC)OC)(=O)NC1C(N(CCCC1)C(C)C)=O