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Benzyl 4-[2-(4-methoxyphenyl)-2-oxoacetyl]piperazine-1-carboxylate
SpectraBase Compound ID 7KNWvMcuPBg
InChI InChI=1S/C21H22N2O5/c1-27-18-9-7-17(8-10-18)19(24)20(25)22-11-13-23(14-12-22)21(26)28-15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3
InChIKey GIIQCFYYUOJMOS-UHFFFAOYSA-N
Mol Weight 382.42 g/mol
Molecular Formula C21H22N2O5
Exact Mass 382.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Jvm4EBARL
Name Benzyl 4-[2-(4-methoxyphenyl)-2-oxoacetyl]piperazine-1-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 382.152871811 u
Formula C21H22N2O5
InChI InChI=1S/C21H22N2O5/c1-27-18-9-7-17(8-10-18)19(24)20(25)22-11-13-23(14-12-22)21(26)28-15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3
InChIKey GIIQCFYYUOJMOS-UHFFFAOYSA-N
Molecular Weight 382.416 g/mol
SMILES C1N(CCN(C1)C(=O)C(=O)C1=CC=C(C=C1)OC)C(=O)OCC1=CC=CC=C1