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3-[(3,5-Dimethoxyphenyl)carbamoyl]-5-norbornene-2-carboxylic acid
SpectraBase Compound ID Grr2RBxX2gB
InChI InChI=1S/C17H19NO5/c1-22-12-6-11(7-13(8-12)23-2)18-16(19)14-9-3-4-10(5-9)15(14)17(20)21/h3-4,6-10,14-15H,5H2,1-2H3,(H,18,19)(H,20,21)
InChIKey VORGYRYRDBMEGX-UHFFFAOYSA-N
Mol Weight 317.34 g/mol
Molecular Formula C17H19NO5
Exact Mass 317.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2Tp67jyyeu
Name 3-[(3,5-Dimethoxyphenyl)carbamoyl]-5-norbornene-2-carboxylic acid
Comments Computed using HOSE algorithm
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Exact Mass 317.126322711 u
Formula C17H19NO5
InChI InChI=1S/C17H19NO5/c1-22-12-6-11(7-13(8-12)23-2)18-16(19)14-9-3-4-10(5-9)15(14)17(20)21/h3-4,6-10,14-15H,5H2,1-2H3,(H,18,19)(H,20,21)
InChIKey VORGYRYRDBMEGX-UHFFFAOYSA-N
Molecular Weight 317.341 g/mol
Nominal Mass 317 u
SMILES OC(C1C2C=CC(C1C(NC=1C=C(C=C(C1)OC)OC)=O)C2)=O