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DIEXO-5,8-METHANO-2-THIOXO-1,4,4A,5,8,8A-HEXAHYDROQUINAZOLINE-4-ONE
SpectraBase Compound ID L9xFJnRlgO8
InChI InChI=1S/C9H10N2OS/c12-8-6-4-1-2-5(3-4)7(6)10-9(13)11-8/h1-2,4-7H,3H2,(H2,10,11,12,13)/t4-,5+,6+,7-/m0/s1
InChIKey QTCRBNFVHWRUDZ-WNJXEPBRSA-N
Mol Weight 194.25 g/mol
Molecular Formula C9H10N2OS
Exact Mass 194.051384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9BnJ076HHSk
Name DIEXO-5,8-METHANO-2-THIOXO-1,4,4A,5,8,8A-HEXAHYDROQUINAZOLINE-4-ONE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10N2OS
InChI InChI=1S/C9H10N2OS/c12-8-6-4-1-2-5(3-4)7(6)10-9(13)11-8/h1-2,4-7H,3H2,(H2,10,11,12,13)/t4-,5+,6+,7-/m0/s1
InChIKey QTCRBNFVHWRUDZ-WNJXEPBRSA-N
Literature Reference Author G.STAJER,A.E.SZABO,P.SOHAR
Literature Reference Citation HETEROCYCLES,51,1849(1999)
Literature Reference DOI 10.3987/COM-99-8560
Molecular Weight 194.251 g/mol
Solvent DMSO-D6
Source File Reference UWSW57