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ETHYL_7-PHENYL-5-TRIFLUOROMETHYL-4,7-DIHYDROTETRAZOLO-[1.5-A]-PYRIMIDINE-6-CARBOXYLATE
SpectraBase Compound ID 9vM1rqIJOtU
InChI InChI=1S/C14H12F3N5O2/c1-2-24-12(23)9-10(8-6-4-3-5-7-8)22-13(19-20-21-22)18-11(9)14(15,16)17/h3-7,10H,2H2,1H3,(H,18,19,21)
InChIKey PTFGXSSJHHUODC-UHFFFAOYSA-N
Mol Weight 339.28 g/mol
Molecular Formula C14H12F3N5O2
Exact Mass 339.094309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID bIK4VCTEC3
Name ETHYL_7-PHENYL-5-TRIFLUOROMETHYL-4,7-DIHYDROTETRAZOLO-[1.5-A]-PYRIMIDINE-6-CARBOXYLATE
Compound Number VII-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12F3N5O2
InChI InChI=1S/C14H12F3N5O2/c1-2-24-12(23)9-10(8-6-4-3-5-7-8)22-13(19-20-21-22)18-11(9)14(15,16)17/h3-7,10H,2H2,1H3,(H,18,19,21)
InChIKey PTFGXSSJHHUODC-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
Molecular Weight 339.277 g/mol
Solvent DMSO-D6
Source File Reference UWMZ16370