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N-[4-({(2E)-2-[(5-methyl-2-furyl)methylene]hydrazino}sulfonyl)phenyl]acetamide
SpectraBase Compound ID vVXa6dVEYR
InChI InChI=1S/C14H15N3O4S/c1-10-3-6-13(21-10)9-15-17-22(19,20)14-7-4-12(5-8-14)16-11(2)18/h3-9,17H,1-2H3,(H,16,18)/b15-9+
InChIKey SHCUWMVABZLOCA-OQLLNIDSSA-N
Mol Weight 321.35 g/mol
Molecular Formula C14H15N3O4S
Exact Mass 321.078327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 30lFP5fYBLG
Name N-[4-({(2E)-2-[(5-methyl-2-furyl)methylene]hydrazino}sulfonyl)phenyl]acetamide
Comments Computed using HOSE algorithm
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Exact Mass 321.078327145 u
Formula C14H15N3O4S
InChI InChI=1S/C14H15N3O4S/c1-10-3-6-13(21-10)9-15-17-22(19,20)14-7-4-12(5-8-14)16-11(2)18/h3-9,17H,1-2H3,(H,16,18)/b15-9+
InChIKey SHCUWMVABZLOCA-OQLLNIDSSA-N
SMILES N(C(=O)C)C1=CC=C(S(N\N=C\C=2OC(C)=CC2)(=O)=O)C=C1