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2,4,6-[3-(TRIFLUOROMETHYL)-PHENOXY]-1,3,5-TRIAZINE
SpectraBase Compound ID 2lXNikWbmNl
InChI InChI=1S/C24H12F9N3O3/c25-22(26,27)13-4-1-7-16(10-13)37-19-34-20(38-17-8-2-5-14(11-17)23(28,29)30)36-21(35-19)39-18-9-3-6-15(12-18)24(31,32)33/h1-12H
InChIKey IAJLBZWUJVKNOR-UHFFFAOYSA-N
Mol Weight 561.36 g/mol
Molecular Formula C24H12F9N3O3
Exact Mass 561.073495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IF81J8nZjcV
Name 2,4,6-[3-(TRIFLUOROMETHYL)-PHENOXY]-1,3,5-TRIAZINE
Compound Number 4K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H12F9N3O3
InChI InChI=1S/C24H12F9N3O3/c25-22(26,27)13-4-1-7-16(10-13)37-19-34-20(38-17-8-2-5-14(11-17)23(28,29)30)36-21(35-19)39-18-9-3-6-15(12-18)24(31,32)33/h1-12H
InChIKey IAJLBZWUJVKNOR-UHFFFAOYSA-N
Literature Reference Author N.MIBU,K.YOKOMIZO,H.AKI,N.OTA,H.FUJII,A.YUZURIHA,S.SANEYOSHI ,A.TANAKA,A.KOGA,J.Z
Literature Reference Citation CHEM.PHARM.BULL.,63,935(2015)
Literature Reference DOI 10.1248/cpb.c15-00309
Molecular Weight 561.363 g/mol
Solvent CDCl3
Source File Reference UWPA10157