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3-Methyl-2-thioxo-2,3,R-4a,cis-5,cis-8,cis-8a-hexahydro-5,8-methanoquinazolin-4(1H)-one
SpectraBase Compound ID Bbvhuk4gWjV
InChI InChI=1S/C10H12N2OS/c1-12-9(13)7-5-2-3-6(4-5)8(7)11-10(12)14/h2-3,5-8H,4H2,1H3,(H,11,14)/t5-,6+,7+,8-/m0/s1
InChIKey JNKZMVIMHHZTPQ-OSMVPFSASA-N
Mol Weight 208.28 g/mol
Molecular Formula C10H12N2OS
Exact Mass 208.067034 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LVrNz5z3O3
Name 3-METHYL-2-THIOXO-2,3,R-4A,CIS-5,CIS-8,CIS-8A-HEXAHYDRO-5,8-METHANOQUINAZOLIN-4(1H)-ONE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12N2OS
InChI InChI=1S/C10H12N2OS/c1-12-9(13)7-5-2-3-6(4-5)8(7)11-10(12)14/h2-3,5-8H,4H2,1H3,(H,11,14)/t5-,6+,7+,8-/m0/s1
InChIKey JNKZMVIMHHZTPQ-OSMVPFSASA-N
Literature Reference Author G.STAJER,A.E.SZABO,J.PINTYE,G.BERNATH,P.SOHAR
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2483(1985)
Literature Reference DOI 10.1039/p19850002483
Molecular Weight 208.278 g/mol
Solvent DMSO-D6
Source File Reference UWGB575