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2-ALLYLTHIO-5-ISOPROPYL-6-(THIEN-2-YL-METHYL)-PYRIMIDINE-4(3H)-ONE
SpectraBase Compound ID 5jUrMSZdmIU
InChI InChI=1S/C15H18N2OS2/c1-4-7-20-15-16-12(9-11-6-5-8-19-11)13(10(2)3)14(18)17-15/h4-6,8,10H,1,7,9H2,2-3H3,(H,16,17,18)
InChIKey BFAACXZPFYPNRY-UHFFFAOYSA-N
Mol Weight 306.44 g/mol
Molecular Formula C15H18N2OS2
Exact Mass 306.086056 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LSNr0HXKOQ
Name 2-ALLYLTHIO-5-ISOPROPYL-6-(THIEN-2-YL-METHYL)-PYRIMIDINE-4(3H)-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18N2OS2
InChI InChI=1S/C15H18N2OS2/c1-4-7-20-15-16-12(9-11-6-5-8-19-11)13(10(2)3)14(18)17-15/h4-6,8,10H,1,7,9H2,2-3H3,(H,16,17,18)
InChIKey BFAACXZPFYPNRY-UHFFFAOYSA-N
Literature Reference Author O.S.PEDERSEN,L.PETERSEN,M.BRANDT,C.NIELSEN,E.B.PEDERSEN
Literature Reference Citation MH.CHEM.,130,1499(1999)
Literature Reference DOI 10.1007/s007060050310
Molecular Weight 306.441 g/mol
Solvent DMSO-D6
Source File Reference UWCS25489