For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-[2-(5-METHYL-2-METHYLSULFANYL-6-OXO-1,6-DIHYDROPYRIMIDIN-1-YL)-ETHYL]-ISOXAZOLE-3-CARBOXAMIDE
SpectraBase Compound ID 6qAhtNBxdFk
InChI InChI=1S/C12H14N4O3S/c1-7-5-14-12(20-2)16(11(7)18)4-3-8-6-19-15-9(8)10(13)17/h5-6H,3-4H2,1-2H3,(H2,13,17)
InChIKey KNWRXCVZUWTFLN-UHFFFAOYSA-N
Mol Weight 294.33 g/mol
Molecular Formula C12H14N4O3S
Exact Mass 294.078661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ii6sKHuZZi2
Name 4-[2-(5-METHYL-2-METHYLSULFANYL-6-OXO-1,6-DIHYDROPYRIMIDIN-1-YL)-ETHYL]-ISOXAZOLE-3-CARBOXAMIDE
Compound Number 51
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N4O3S
InChI InChI=1S/C12H14N4O3S/c1-7-5-14-12(20-2)16(11(7)18)4-3-8-6-19-15-9(8)10(13)17/h5-6H,3-4H2,1-2H3,(H2,13,17)
InChIKey KNWRXCVZUWTFLN-UHFFFAOYSA-N
Literature Reference Author C.PEREZ,Y.L.JANIN,D.R.ADAMS,C.MONNERET,D.S.GRIERSON
Literature Reference Citation J.CHEM.SOC.PERKIN-1,901(1997)
Literature Reference DOI 10.1039/a605995c
Molecular Weight 294.328 g/mol
Solvent CDCl3
Source File Reference UWRU11237