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5-[(4-chloro-1H-pyrazol-1-yl)methyl]-N-(2,4-difluorophenyl)-2-furamide

View entire compound with spectra: 2 NMR

5-[(4-chloro-1H-pyrazol-1-yl)methyl]-N-(2,4-difluorophenyl)-2-furamide
SpectraBase Compound ID 7xdagOWvSMw
InChI InChI=1S/C15H10ClF2N3O2/c16-9-6-19-21(7-9)8-11-2-4-14(23-11)15(22)20-13-3-1-10(17)5-12(13)18/h1-7H,8H2,(H,20,22)
InChIKey JBRHWHWJPMDFTN-UHFFFAOYSA-N
Mol Weight 337.71 g/mol
Molecular Formula C15H10ClF2N3O2
Exact Mass 337.042961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 654KxiOsFuI
Name 5-[(4-Chloro-1H-pyrazol-1-yl)methyl]-N-(2,4-difluorophenyl)-2-furamide
Comments Computed using HOSE algorithm
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Exact Mass 337.042960598 u
Formula C15H10ClF2N3O2
InChI InChI=1S/C15H10ClF2N3O2/c16-9-6-19-21(7-9)8-11-2-4-14(23-11)15(22)20-13-3-1-10(17)5-12(13)18/h1-7H,8H2,(H,20,22)
InChIKey JBRHWHWJPMDFTN-UHFFFAOYSA-N
Molecular Weight 337.714 g/mol
SMILES N(C=1C(=CC(=CC1)F)F)C(C=1OC(CN2N=CC(=C2)Cl)=CC1)=O