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(4AR*,6R*,7AS*)-6-TERT.-BUTYL-2-THIOXO-1,2,3,4A,5,6,7,7A-OCTAHYDROCYCLOPENTA-[D]-PYRIMIDIN-4-ONE
SpectraBase Compound ID A5AV0pBJGzV
InChI InChI=1S/C11H18N2OS/c1-11(2,3)6-4-7-8(5-6)12-10(15)13-9(7)14/h6-8H,4-5H2,1-3H3,(H2,12,13,14,15)/t6-,7-,8+/m0/s1
InChIKey UVYHEYMZDDKFIV-BIIVOSGPSA-N
Mol Weight 226.34 g/mol
Molecular Formula C11H18N2OS
Exact Mass 226.113984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5jFPu4XdsWH
Name (4AR*,6R*,7AS*)-6-TERT.-BUTYL-2-THIOXO-1,2,3,4A,5,6,7,7A-OCTAHYDROCYCLOPENTA-[D]-PYRIMIDIN-4-ONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18N2OS
InChI InChI=1S/C11H18N2OS/c1-11(2,3)6-4-7-8(5-6)12-10(15)13-9(7)14/h6-8H,4-5H2,1-3H3,(H2,12,13,14,15)/t6-,7-,8+/m0/s1
InChIKey UVYHEYMZDDKFIV-BIIVOSGPSA-N
Literature Reference Author Z.SZAKONYI,F.FUELOEP,G.BERNATH,P.SOHAR
Literature Reference Citation HETEROCYCLES,42,625(1996)
Literature Reference DOI 10.3987/COM-95-S54
Molecular Weight 226.337 g/mol
Solvent DMSO-D6
Source File Reference UWCP6040