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N-(3-Tolyl)-2,2-bis(ethoxycarbonyl)acetamide
SpectraBase Compound ID JnV0pgNDetL
InChI InChI=1S/C15H19NO5/c1-4-20-14(18)12(15(19)21-5-2)13(17)16-11-8-6-7-10(3)9-11/h6-9,12H,4-5H2,1-3H3,(H,16,17)
InChIKey YSGRTEQBBHCJQQ-UHFFFAOYSA-N
Mol Weight 293.32 g/mol
Molecular Formula C15H19NO5
Exact Mass 293.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID d4ObGAoHIz
Name N-(3-Tolyl)-2,2-bis(ethoxycarbonyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 293.126322711 u
Formula C15H19NO5
InChI InChI=1S/C15H19NO5/c1-4-20-14(18)12(15(19)21-5-2)13(17)16-11-8-6-7-10(3)9-11/h6-9,12H,4-5H2,1-3H3,(H,16,17)
InChIKey YSGRTEQBBHCJQQ-UHFFFAOYSA-N
SMILES C1(NC(C(C(OCC)=O)C(OCC)=O)=O)=CC(=CC=C1)C