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3-(4-HYDROXYPHENYL)-6-ISOPROPYLTHIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[4,3-A]-PYRIMIDIN-5(1H)-ONE
SpectraBase Compound ID ChKNNdCWKvS
InChI InChI=1S/C16H14N4O2S/c1-8(2)11-7-23-14-12(11)15(22)20-13(18-19-16(20)17-14)9-3-5-10(21)6-4-9/h3-8,21H,1-2H3,(H,17,19)
InChIKey WTSFLFODMILBAW-UHFFFAOYSA-N
Mol Weight 326.37 g/mol
Molecular Formula C16H14N4O2S
Exact Mass 326.083747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJrc4b3B3hA
Name 3-(4-HYDROXYPHENYL)-6-ISOPROPYLTHIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[4,3-A]-PYRIMIDIN-5(1H)-ONE
Compound Number 11G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14N4O2S
InChI InChI=1S/C16H14N4O2S/c1-8(2)11-7-23-14-12(11)15(22)20-13(18-19-16(20)17-14)9-3-5-10(21)6-4-9/h3-8,21H,1-2H3,(H,17,19)
InChIKey WTSFLFODMILBAW-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 326.373 g/mol
Sample ID 39839
Solvent DMSO-D6