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1-N-BUTYL-2,3-DIHYDRO-2-THIOXO-1H-IMIDAZOLE-4-CARBOXALDEHYDE
SpectraBase Compound ID 7DTJcphIZWi
InChI InChI=1S/C8H12N2OS/c1-2-3-4-10-5-7(6-11)9-8(10)12/h5-6H,2-4H2,1H3,(H,9,12)
InChIKey DQSGJXUPTDMHTL-UHFFFAOYSA-N
Mol Weight 184.26 g/mol
Molecular Formula C8H12N2OS
Exact Mass 184.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LnQVV9VJeE2
Name 1-N-BUTYL-2,3-DIHYDRO-2-THIOXO-1H-IMIDAZOLE-4-CARBOXALDEHYDE
CAS Registry Number 123540-57-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12N2OS
InChI InChI=1S/C8H12N2OS/c1-2-3-4-10-5-7(6-11)9-8(10)12/h5-6H,2-4H2,1H3,(H,9,12)
InChIKey DQSGJXUPTDMHTL-UHFFFAOYSA-N
Literature Reference Author I.ROBINA,J.FUENTES,J.FERNANDEZ-BOLANOS,M.D.ESTRADA,A.LOPEZ-C ASTRO
Literature Reference Citation J.ORG.CHEM.,55,750(1990)
Literature Reference DOI 10.1021/jo00289a060
Molecular Weight 184.256 g/mol
Solvent DMSO-D6
Source File Reference UWED14663