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3-PHENYL-6,7-DIHYDRO-5H-1,2,4-THIADIAZOLO-[4,5-A]-PYRIMIDINE
SpectraBase Compound ID IpinsxcKG8p
InChI InChI=1S/C11H11N3S/c1-2-5-9(6-3-1)10-13-15-11-12-7-4-8-14(10)11/h1-3,5-6H,4,7-8H2
InChIKey DQDXFBSAXWLSGB-UHFFFAOYSA-N
Mol Weight 217.29 g/mol
Molecular Formula C11H11N3S
Exact Mass 217.067369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3KJ9gOY5mIN
Name 3-PHENYL-6,7-DIHYDRO-5H-1,2,4-THIADIAZOLO-[4,5-A]-PYRIMIDINE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11N3S
InChI InChI=1S/C11H11N3S/c1-2-5-9(6-3-1)10-13-15-11-12-7-4-8-14(10)11/h1-3,5-6H,4,7-8H2
InChIKey DQDXFBSAXWLSGB-UHFFFAOYSA-N
Literature Reference Author L.L.LAI,T.H.NGOI,D.H.REID,R.H.NICOL,J.B.RHODES
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1753(1993)
Literature Reference DOI 10.1039/p19930001753
Molecular Weight 217.288 g/mol
Solvent CDCl3
Source File Reference UWCP1412