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Indole-3-carboxaldehyde, thiocarbohydrazone

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

Indole-3-carboxaldehyde, thiocarbohydrazone
SpectraBase Compound ID GmJKbGxomA4
InChI InChI=1S/C19H16N6S/c26-19(24-22-11-13-9-20-17-7-3-1-5-15(13)17)25-23-12-14-10-21-18-8-4-2-6-16(14)18/h1-12,20-21H,(H2,24,25,26)/b22-11+,23-12+
InChIKey LLXJYAHZODWPGB-LCHFAGMQSA-N
Mol Weight 360.44 g/mol
Molecular Formula C19H16N6S
Exact Mass 360.115716 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ojnLXppeDC
Name Indole-3-carboxaldehyde, thiocarbohydrazone
Comments Computed using HOSE algorithm
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Exact Mass 360.115715713 u
Formula C19H16N6S
InChI InChI=1S/C19H16N6S/c26-19(24-22-11-13-9-20-17-7-3-1-5-15(13)17)25-23-12-14-10-21-18-8-4-2-6-16(14)18/h1-12,20-21H,(H2,24,25,26)/b22-11+,23-12+
InChIKey LLXJYAHZODWPGB-LCHFAGMQSA-N
Molecular Weight 360.439 g/mol
SMILES N1C=2C=CC=CC2C(\C=N\NC(N\N=C\C=2C=3C=CC=CC3NC2)=S)=C1