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3-(3-CHLORO-PHENYL)-8,9,10,11-TETRAHYDRO-[1]-BENZO-THIENO-[3,2-E]-[1,2,4]-TRIAZOLO-[4,3-C]-PYRIMIDINE
SpectraBase Compound ID CKUAaHL6oNK
InChI InChI=1S/C17H13ClN4S/c18-11-5-3-4-10(8-11)15-20-21-16-14-12-6-1-2-7-13(12)23-17(14)19-9-22(15)16/h3-5,8-9H,1-2,6-7H2
InChIKey MTTFATYDKWWQFY-UHFFFAOYSA-N
Mol Weight 340.83 g/mol
Molecular Formula C17H13ClN4S
Exact Mass 340.054945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0XBhHU64Bc
Name 3-(3-CHLORO-PHENYL)-8,9,10,11-TETRAHYDRO-[1]-BENZO-THIENO-[3,2-E]-[1,2,4]-TRIAZOLO-[4,3-C]-PYRIMIDINE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13ClN4S
InChI InChI=1S/C17H13ClN4S/c18-11-5-3-4-10(8-11)15-20-21-16-14-12-6-1-2-7-13(12)23-17(14)19-9-22(15)16/h3-5,8-9H,1-2,6-7H2
InChIKey MTTFATYDKWWQFY-UHFFFAOYSA-N
Literature Reference Author R.SOLIMAN,N.S.HABIB,A.A.EL-TOMBARY,S.A.M.EL-HAWASH,O.G.SHAAB AN
Literature Reference Citation SCI.PHARM.,77,755(2009)
Molecular Weight 340.830 g/mol
Sample ID 2972
Solvent CDCl3