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1-[1-(3-Bromophenyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxamide
SpectraBase Compound ID EPrKagrmNuC
InChI InChI=1S/C16H18BrN3O3/c17-11-2-1-3-12(8-11)20-14(21)9-13(16(20)23)19-6-4-10(5-7-19)15(18)22/h1-3,8,10,13H,4-7,9H2,(H2,18,22)
InChIKey XPUAMUNNJROASA-UHFFFAOYSA-N
Mol Weight 380.24 g/mol
Molecular Formula C16H18BrN3O3
Exact Mass 379.053154 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TC10nryzXr
Name 1-[1-(3-Bromophenyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 379.053154449 u
Formula C16H18BrN3O3
InChI InChI=1S/C16H18BrN3O3/c17-11-2-1-3-12(8-11)20-14(21)9-13(16(20)23)19-6-4-10(5-7-19)15(18)22/h1-3,8,10,13H,4-7,9H2,(H2,18,22)
InChIKey XPUAMUNNJROASA-UHFFFAOYSA-N
Molecular Weight 380.242 g/mol
SMILES NC(C1CCN(C2C(N(C(C2)=O)C2=CC(Br)=CC=C2)=O)CC1)=O