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2,6-Difluoro-N-[1-(2-methylbenzyl)-2-oxoazepan-3-yl]benzamide

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2,6-Difluoro-N-[1-(2-methylbenzyl)-2-oxoazepan-3-yl]benzamide
SpectraBase Compound ID DKCkcGsWC3Z
InChI InChI=1S/C21H22F2N2O2/c1-14-7-2-3-8-15(14)13-25-12-5-4-11-18(21(25)27)24-20(26)19-16(22)9-6-10-17(19)23/h2-3,6-10,18H,4-5,11-13H2,1H3,(H,24,26)
InChIKey MOPCDRMHSYMDMU-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H22F2N2O2
Exact Mass 372.164934 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F40OApV2L2B
Name 2,6-Difluoro-N-[1-(2-methylbenzyl)-2-oxoazepan-3-yl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.164934280 u
Formula C21H22F2N2O2
InChI InChI=1S/C21H22F2N2O2/c1-14-7-2-3-8-15(14)13-25-12-5-4-11-18(21(25)27)24-20(26)19-16(22)9-6-10-17(19)23/h2-3,6-10,18H,4-5,11-13H2,1H3,(H,24,26)
InChIKey MOPCDRMHSYMDMU-UHFFFAOYSA-N
Molecular Weight 372.416 g/mol
SMILES C(C1=C(C=CC=C1F)F)(=O)NC1C(N(CCCC1)CC1=C(C=CC=C1)C)=O