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1-(4-CHLOROPHENYL)-6,7,8,9-TETRAHYDRO-4H-BENZO-[4,5]-THIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[3,4-B]-PYRIMIDIN-5-ONE
SpectraBase Compound ID Ih69TQYrhEu
InChI InChI=1S/C17H13ClN4OS/c18-10-7-5-9(6-8-10)14-20-21-17-19-15(23)13-11-3-1-2-4-12(11)24-16(13)22(14)17/h5-8H,1-4H2,(H,19,21,23)
InChIKey UUPOVKZSZNKHPP-UHFFFAOYSA-N
Mol Weight 356.83 g/mol
Molecular Formula C17H13ClN4OS
Exact Mass 356.04986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETzTdVTnLjq
Name 1-(4-CHLOROPHENYL)-6,7,8,9-TETRAHYDRO-4H-BENZO-[4,5]-THIENO-[2,3-D]-[1,2,4]-TRIAZOLO-[3,4-B]-PYRIMIDIN-5-ONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13ClN4OS
InChI InChI=1S/C17H13ClN4OS/c18-10-7-5-9(6-8-10)14-20-21-17-19-15(23)13-11-3-1-2-4-12(11)24-16(13)22(14)17/h5-8H,1-4H2,(H,19,21,23)
InChIKey UUPOVKZSZNKHPP-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 356.829 g/mol
Sample ID 70960
Solvent DMSO-D6