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N-[1-(2-Methylbenzyl)-2-oxoazepan-3-yl]benzamide

View entire compound with spectra: 1 NMR

N-[1-(2-Methylbenzyl)-2-oxoazepan-3-yl]benzamide
SpectraBase Compound ID 19Ps0EsGWEj
InChI InChI=1S/C21H24N2O2/c1-16-9-5-6-12-18(16)15-23-14-8-7-13-19(21(23)25)22-20(24)17-10-3-2-4-11-17/h2-6,9-12,19H,7-8,13-15H2,1H3,(H,22,24)
InChIKey XDBAVIIZJNJNKT-UHFFFAOYSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ZA9AthKS2b
Name N-[1-(2-Methylbenzyl)-2-oxoazepan-3-yl]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 336.183778019 u
Formula C21H24N2O2
InChI InChI=1S/C21H24N2O2/c1-16-9-5-6-12-18(16)15-23-14-8-7-13-19(21(23)25)22-20(24)17-10-3-2-4-11-17/h2-6,9-12,19H,7-8,13-15H2,1H3,(H,22,24)
InChIKey XDBAVIIZJNJNKT-UHFFFAOYSA-N
Molecular Weight 336.435 g/mol
SMILES C(C1=CC=CC=C1)(=O)NC1C(N(CCCC1)CC1=C(C=CC=C1)C)=O