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N-((E)-2-[2-PHENYL-4,4-BIS-(TRIFLUOROMETHYL)-2-OXAZOLIN-5-YLIDENE]-2-(3-PYRIDINYL)-1,1-BIS-(TRIFLUOROMETHYL)-ETHYL)-BENZAMIDE

View entire compound with spectra: 2 NMR

N-((E)-2-[2-PHENYL-4,4-BIS-(TRIFLUOROMETHYL)-2-OXAZOLIN-5-YLIDENE]-2-(3-PYRIDINYL)-1,1-BIS-(TRIFLUOROMETHYL)-ETHYL)-BENZAMIDE
SpectraBase Compound ID H48XLfDu6yK
InChI InChI=1S/C27H15F12N3O2/c28-24(29,30)22(25(31,32)33,41-20(43)15-8-3-1-4-9-15)18(17-12-7-13-40-14-17)19-23(26(34,35)36,27(37,38)39)42-21(44-19)16-10-5-2-6-11-16/h1-14H,(H,41,43)/b19-18+
InChIKey ROLBLMAYTCHTJK-VHEBQXMUSA-N
Mol Weight 641.42 g/mol
Molecular Formula C27H15F12N3O2
Exact Mass 641.097265 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IBLRZGBBlxK
Name N-((E)-2-[2-PHENYL-4,4-BIS-(TRIFLUOROMETHYL)-2-OXAZOLIN-5-YLIDENE]-2-(3-PYRIDINYL)-1,1-BIS-(TRIFLUOROMETHYL)-ETHYL)-BENZAMIDE
Compound Number 8D1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H15F12N3O2
InChI InChI=1S/C27H15F12N3O2/c28-24(29,30)22(25(31,32)33,41-20(43)15-8-3-1-4-9-15)18(17-12-7-13-40-14-17)19-23(26(34,35)36,27(37,38)39)42-21(44-19)16-10-5-2-6-11-16/h1-14H,(H,41,43)/b19-18+
InChIKey ROLBLMAYTCHTJK-VHEBQXMUSA-N
Literature Reference Author K.BURGER,N.SEWALD,E.HUBER,R.OTTLINGER
Literature Reference Citation Z.NATURFORSCH.,44B,1298(1989)
Molecular Weight 641.416 g/mol
Solvent CDCl3
Source File Reference UWCS13331