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5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-ethoxyphenyl)-2-furamide
SpectraBase Compound ID AQxKLEZCzBY
InChI InChI=1S/C19H21N3O3/c1-4-24-16-7-5-15(6-8-16)20-19(23)18-10-9-17(25-18)12-22-14(3)11-13(2)21-22/h5-11H,4,12H2,1-3H3,(H,20,23)
InChIKey OVCNZDJBABGZFK-UHFFFAOYSA-N
Mol Weight 339.4 g/mol
Molecular Formula C19H21N3O3
Exact Mass 339.158292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BM7kcaCxA2u
Name 5-[(3,5-Dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-ethoxyphenyl)-2-furamide
Comments Computed using HOSE algorithm
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Exact Mass 339.158291545 u
Formula C19H21N3O3
InChI InChI=1S/C19H21N3O3/c1-4-24-16-7-5-15(6-8-16)20-19(23)18-10-9-17(25-18)12-22-14(3)11-13(2)21-22/h5-11H,4,12H2,1-3H3,(H,20,23)
InChIKey OVCNZDJBABGZFK-UHFFFAOYSA-N
Molecular Weight 339.395 g/mol
SMILES N(C1=CC=C(OCC)C=C1)C(C=1OC(CN2N=C(C)C=C2C)=CC1)=O