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CIS-1-BENZYL-3-METHYL-THIOXO-1,2,3,4A,5,6,7,7A-OCTAHYDRO-CYCLOPENTA-[D]-PYRIMIDINE-4-ONE
SpectraBase Compound ID 2YUb2ydlPrW
InChI InChI=1S/C15H18N2OS/c1-16-14(18)12-8-5-9-13(12)17(15(16)19)10-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m1/s1
InChIKey DCJHXWRTUONQME-OLZOCXBDSA-N
Mol Weight 274.38 g/mol
Molecular Formula C15H18N2OS
Exact Mass 274.113984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tcQVDmji2q
Name CIS-1-BENZYL-3-METHYL-THIOXO-1,2,3,4A,5,6,7,7A-OCTAHYDRO-CYCLOPENTA-[D]-PYRIMIDINE-4-ONE
Compound Number 12D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18N2OS
InChI InChI=1S/C15H18N2OS/c1-16-14(18)12-8-5-9-13(12)17(15(16)19)10-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m1/s1
InChIKey DCJHXWRTUONQME-OLZOCXBDSA-N
Literature Reference Author F.FUELOEP,Z.SZAKONYI,G.BERNATH,P.SOHAR
Literature Reference Citation J.HETCYCL.CHEM.,34,1211(1997)
Literature Reference DOI 10.1002/jhet.5570340419
Molecular Weight 274.381 g/mol
Solvent CDCl3
Source File Reference UWSW717