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3-(4-BROMOPHENYL)-6-ISOPROPYLTHIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[4,3-A]-PYRIMIDIN-5(1H)-ONE
SpectraBase Compound ID CASjuHeFkOj
InChI InChI=1S/C16H13BrN4OS/c1-8(2)11-7-23-14-12(11)15(22)21-13(19-20-16(21)18-14)9-3-5-10(17)6-4-9/h3-8H,1-2H3,(H,18,20)
InChIKey JQFIQJIAZOHYQP-UHFFFAOYSA-N
Mol Weight 389.27 g/mol
Molecular Formula C16H13BrN4OS
Exact Mass 387.999345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID SdWpKHnfWi
Name 3-(4-BROMOPHENYL)-6-ISOPROPYLTHIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[4,3-A]-PYRIMIDIN-5(1H)-ONE
Compound Number 11F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13BrN4OS
InChI InChI=1S/C16H13BrN4OS/c1-8(2)11-7-23-14-12(11)15(22)21-13(19-20-16(21)18-14)9-3-5-10(17)6-4-9/h3-8H,1-2H3,(H,18,20)
InChIKey JQFIQJIAZOHYQP-UHFFFAOYSA-N
Literature Reference Author A.A.HAMED,I.F.ZEID,H.H.EL-GANZORY,M.T.A.AAL
Literature Reference Citation MH.CHEM.,139,809(2008)
Literature Reference DOI 10.1007/s00706-007-0823-y
Molecular Weight 389.269 g/mol
Sample ID 39838
Solvent DMSO-D6