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Glyoxal, bis(4-furfuryl-3-thiosemicarbazone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

Glyoxal, bis(4-furfuryl-3-thiosemicarbazone
SpectraBase Compound ID 8nmVrViQ1gV
InChI InChI=1S/C14H16N6O2S2/c23-13(15-9-11-3-1-7-21-11)19-17-5-6-18-20-14(24)16-10-12-4-2-8-22-12/h1-8H,9-10H2,(H2,15,19,23)(H2,16,20,24)/b17-5+,18-6+
InChIKey RNYPJBDPXTUYQQ-QJZPKIEXSA-N
Mol Weight 364.44 g/mol
Molecular Formula C14H16N6O2S2
Exact Mass 364.077616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EnpV0sqEwhM
Name Glyoxal, bis(4-furfuryl-3-thiosemicarbazone
Comments Computed using HOSE algorithm
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Exact Mass 364.077616125 u
Formula C14H16N6O2S2
InChI InChI=1S/C14H16N6O2S2/c23-13(15-9-11-3-1-7-21-11)19-17-5-6-18-20-14(24)16-10-12-4-2-8-22-12/h1-8H,9-10H2,(H2,15,19,23)(H2,16,20,24)/b17-5+,18-6+
InChIKey RNYPJBDPXTUYQQ-QJZPKIEXSA-N
Molecular Weight 364.442 g/mol
SMILES N(C(NCC=1OC=CC1)=S)\N=C\C=N\NC(NCC1=CC=CO1)=S