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5-Methyl-2-thiophenecarboxaldehyde, 4-(2-naphthyl)-3-thiosemicarbazone
SpectraBase Compound ID 9j5lmQh0ecW
InChI InChI=1S/C17H15N3S2/c1-12-6-9-16(22-12)11-18-20-17(21)19-15-8-7-13-4-2-3-5-14(13)10-15/h2-11H,1H3,(H2,19,20,21)/b18-11+
InChIKey DDBUQOSLNOJLQO-WOJGMQOQSA-N
Mol Weight 325.45 g/mol
Molecular Formula C17H15N3S2
Exact Mass 325.07074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ykm2X6DpZx
Name 5-Methyl-2-thiophenecarboxaldehyde, 4-(2-naphthyl)-3-thiosemicarbazone
Comments Computed using HOSE algorithm
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Exact Mass 325.070739843 u
Formula C17H15N3S2
InChI InChI=1S/C17H15N3S2/c1-12-6-9-16(22-12)11-18-20-17(21)19-15-8-7-13-4-2-3-5-14(13)10-15/h2-11H,1H3,(H2,19,20,21)/b18-11+
InChIKey DDBUQOSLNOJLQO-WOJGMQOQSA-N
Molecular Weight 325.448 g/mol
SMILES N(C1=CC=C2C=CC=CC2=C1)C(N\N=C\C1=CC=C(S1)C)=S