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1,4-bis(4-methoxybenzoyl)hexahydro-1H-1,4-diazepine

View entire compound with spectra: 2 NMR

1,4-bis(4-methoxybenzoyl)hexahydro-1H-1,4-diazepine
SpectraBase Compound ID Ein7OsnePCp
InChI InChI=1S/C21H24N2O4/c1-26-18-8-4-16(5-9-18)20(24)22-12-3-13-23(15-14-22)21(25)17-6-10-19(27-2)11-7-17/h4-11H,3,12-15H2,1-2H3
InChIKey FVVJGEDYSJEHTD-UHFFFAOYSA-N
Mol Weight 368.43 g/mol
Molecular Formula C21H24N2O4
Exact Mass 368.173607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RT4mI3CGW2
Name 1,4-bis(4-Methoxybenzoyl)hexahydro-1H-1,4-diazepine
Comments Computed using HOSE algorithm
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Exact Mass 368.173607257 u
Formula C21H24N2O4
InChI InChI=1S/C21H24N2O4/c1-26-18-8-4-16(5-9-18)20(24)22-12-3-13-23(15-14-22)21(25)17-6-10-19(27-2)11-7-17/h4-11H,3,12-15H2,1-2H3
InChIKey FVVJGEDYSJEHTD-UHFFFAOYSA-N
Molecular Weight 368.433 g/mol
SMILES C(N1CCN(C(C2=CC=C(C=C2)OC)=O)CCC1)(C=1C=CC(=CC1)OC)=O