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1-Pyridineacetic acid, hexahydro-, N'-[(phenylamino)carbonothioyl]hydrazide
SpectraBase Compound ID 359EaGBGolq
InChI InChI=1S/C14H20N4OS/c19-13(11-18-9-5-2-6-10-18)16-17-14(20)15-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,16,19)(H2,15,17,20)
InChIKey DQYJUCBEJKIVMM-UHFFFAOYSA-N
Mol Weight 292.4 g/mol
Molecular Formula C14H20N4OS
Exact Mass 292.135782 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vMDgP2WKN
Name 1-Pyridineacetic acid, hexahydro-, N'-[(phenylamino)carbonothioyl]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 292.135782453 u
Formula C14H20N4OS
InChI InChI=1S/C14H20N4OS/c19-13(11-18-9-5-2-6-10-18)16-17-14(20)15-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,16,19)(H2,15,17,20)
InChIKey DQYJUCBEJKIVMM-UHFFFAOYSA-N
Molecular Weight 292.401 g/mol
SMILES C(NNC(CN1CCCCC1)=O)(NC=1C=CC=CC1)=S