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N-(4-methylphenyl)-2-[5-(1H-pyrazol-1-ylmethyl)-2-furoyl]hydrazinecarboxamide
SpectraBase Compound ID U2HG1P1p8C
InChI InChI=1S/C17H17N5O3/c1-12-3-5-13(6-4-12)19-17(24)21-20-16(23)15-8-7-14(25-15)11-22-10-2-9-18-22/h2-10H,11H2,1H3,(H,20,23)(H2,19,21,24)
InChIKey BDGQLWARFIRCFX-UHFFFAOYSA-N
Mol Weight 339.36 g/mol
Molecular Formula C17H17N5O3
Exact Mass 339.133139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSB7Gtr6xRz
Name N-(4-Methylphenyl)-2-[5-(1H-pyrazol-1-ylmethyl)-2-furoyl]hydrazinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 339.133139424 u
Formula C17H17N5O3
InChI InChI=1S/C17H17N5O3/c1-12-3-5-13(6-4-12)19-17(24)21-20-16(23)15-8-7-14(25-15)11-22-10-2-9-18-22/h2-10H,11H2,1H3,(H,20,23)(H2,19,21,24)
InChIKey BDGQLWARFIRCFX-UHFFFAOYSA-N
Molecular Weight 339.355 g/mol
SMILES N(C(C=1OC(CN2N=CC=C2)=CC1)=O)NC(NC1=CC=C(C)C=C1)=O