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1-(4-chloro-2,5-dimethoxyphenyl)-3-[(4-pyridyl)methyl]-2-thiourea
SpectraBase Compound ID CBOmlEFNnyE
InChI InChI=1S/C15H16ClN3O2S/c1-20-13-8-12(14(21-2)7-11(13)16)19-15(22)18-9-10-3-5-17-6-4-10/h3-8H,9H2,1-2H3,(H2,18,19,22)
InChIKey GBTBXYPZRZHCNA-UHFFFAOYSA-N
Mol Weight 337.83 g/mol
Molecular Formula C15H16ClN3O2S
Exact Mass 337.065176 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPRAdmgLbnj
Name 1-(4-chloro-2,5-dimethoxyphenyl)-3-[(4-pyridyl)methyl]-2-thiourea
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Formula C15H16ClN3O2S
InChI InChI=1S/C15H16ClN3O2S/c1-20-13-8-12(14(21-2)7-11(13)16)19-15(22)18-9-10-3-5-17-6-4-10/h3-8H,9H2,1-2H3,(H2,18,19,22)
InChIKey GBTBXYPZRZHCNA-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 24830M
Solvent DMSO-d6