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4,5-DIBENZYL-2-(2,2,2-TRIFLUOROETHYLIDENE)-6-TRIFLUOROMETHYL-2,3-DIHYDRO-4H-1,4-OXAZIN-3-ONE
SpectraBase Compound ID 2hlArTAwkUP
InChI InChI=1S/C21H15F6NO2/c22-20(23,24)12-17-19(29)28(13-15-9-5-2-6-10-15)16(18(30-17)21(25,26)27)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2/b17-12-
InChIKey CMSCALGLOTUIJG-ATVHPVEESA-N
Mol Weight 427.35 g/mol
Molecular Formula C21H15F6NO2
Exact Mass 427.100698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2eGb7pmQdDl
Name 4,5-DIBENZYL-2-(2,2,2-TRIFLUOROETHYLIDENE)-6-TRIFLUOROMETHYL-2,3-DIHYDRO-4H-1,4-OXAZIN-3-ONE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H15F6NO2
InChI InChI=1S/C21H15F6NO2/c22-20(23,24)12-17-19(29)28(13-15-9-5-2-6-10-15)16(18(30-17)21(25,26)27)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2/b17-12-
InChIKey CMSCALGLOTUIJG-ATVHPVEESA-N
Literature Reference Author M.KAWASE,S.SAITO,H.KIKUCHI,H.MIYAMAE
Literature Reference Citation HETEROCYCLES,45,2185(1997)
Literature Reference DOI 10.3987/COM-97-7936
Molecular Weight 427.346 g/mol
Solvent Unknown
Source File Reference UWCP6162