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ETHYL_5-HYDROXY-7-(4-METHOXYPHENYL)-5-TRIFLUOROMETHYL-TETRAZOLO-[1.5-A]-PYRIMIDINE-6-CARBOXYLATE
SpectraBase Compound ID 9CheHGlGg1z
InChI InChI=1S/C15H16F3N5O4/c1-3-27-12(24)10-11(8-4-6-9(26-2)7-5-8)23-13(20-21-22-23)19-14(10,25)15(16,17)18/h4-7,10-11,25H,3H2,1-2H3,(H,19,20,22)
InChIKey JMVUMEGTGZVPDJ-UHFFFAOYSA-N
Mol Weight 387.32 g/mol
Molecular Formula C15H16F3N5O4
Exact Mass 387.115439 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7ByGLbh8uZ
Name ETHYL_5-HYDROXY-7-(4-METHOXYPHENYL)-5-TRIFLUOROMETHYL-TETRAZOLO-[1.5-A]-PYRIMIDINE-6-CARBOXYLATE
Compound Number IV-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16F3N5O4
InChI InChI=1S/C15H16F3N5O4/c1-3-27-12(24)10-11(8-4-6-9(26-2)7-5-8)23-13(20-21-22-23)19-14(10,25)15(16,17)18/h4-7,10-11,25H,3H2,1-2H3,(H,19,20,22)
InChIKey JMVUMEGTGZVPDJ-UHFFFAOYSA-N
Literature Reference Author M.V.PRYADEINA,Y.V.BURGART,V.I.SALOUTIN,M.I.KODESS,E.N.ULOMSK II,V.L.RUSINOV
Literature Reference Citation RUSS.J.ORG.CHEM.,40,902(2004)
Literature Reference DOI 10.1023/B:RUJO.0000044558.47152.65
Solvent DMSO-D6
Source File Reference UWMZ16361