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6-TRIFLUOROMETHYL-1,4,5,6-TETRAHYDRO-1-METHOXYCARBONYL-4-METHYL-3-PHENYL-1,2,4-TRIAZIN-6-OL
SpectraBase Compound ID 1uPzCJcPIYD
InChI InChI=1S/C13H14F3N3O3/c1-18-8-12(21,13(14,15)16)19(11(20)22-2)17-10(18)9-6-4-3-5-7-9/h3-7,21H,8H2,1-2H3
InChIKey FNEZOVWZRFJBRZ-UHFFFAOYSA-N
Mol Weight 317.27 g/mol
Molecular Formula C13H14F3N3O3
Exact Mass 317.098726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbhR5mSowjL
Name 6-TRIFLUOROMETHYL-1,4,5,6-TETRAHYDRO-1-METHOXYCARBONYL-4-METHYL-3-PHENYL-1,2,4-TRIAZIN-6-OL
Compound Number 3J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14F3N3O3
InChI InChI=1S/C13H14F3N3O3/c1-18-8-12(21,13(14,15)16)19(11(20)22-2)17-10(18)9-6-4-3-5-7-9/h3-7,21H,8H2,1-2H3
InChIKey FNEZOVWZRFJBRZ-UHFFFAOYSA-N
Literature Reference Author M.KAWASE,H.KOIWAI
Literature Reference Citation CHEM.PHARM.BULL.,56,433(2008)
Literature Reference DOI 10.1248/cpb.56.433
Molecular Weight 317.268 g/mol
Sample ID 1460
Solvent CDCl3