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(CIS)-2-(4-NITROBENZYLOXY)-TETRAHYDROPYRAN-5-YL-[ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYLPHENYLACETATE)]
SpectraBase Compound ID ARwZDQPrqMo
InChI InChI=1S/C22H22F3NO7/c1-30-21(22(23,24)25,16-5-3-2-4-6-16)20(27)33-18-11-12-19(32-14-18)31-13-15-7-9-17(10-8-15)26(28)29/h2-10,18-19H,11-14H2,1H3/t18-,19-,21?/m0/s1
InChIKey NFYXEGVIMSKAOZ-CHEUHSMRSA-N
Mol Weight 469.41 g/mol
Molecular Formula C22H22F3NO7
Exact Mass 469.134837 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HzRRBG2FYw2
Name (CIS)-2-(4-NITROBENZYLOXY)-TETRAHYDROPYRAN-5-YL-[ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYLPHENYLACETATE)]
Compound Number 14D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22F3NO7
InChI InChI=1S/C22H22F3NO7/c1-30-21(22(23,24)25,16-5-3-2-4-6-16)20(27)33-18-11-12-19(32-14-18)31-13-15-7-9-17(10-8-15)26(28)29/h2-10,18-19H,11-14H2,1H3/t18-,19-,21?/m0/s1
InChIKey NFYXEGVIMSKAOZ-CHEUHSMRSA-N
Literature Reference Author E.O.REILLY,S.J.AITKEN,G.GROGAN,P.P.KELLY,N.J.TURNER,S.L.FLIT SCH
Literature Reference Citation BEIL.J.ORG.CHEM.,8,496(2012)
Literature Reference DOI 10.3762/bjoc.8.56
Solvent CDCl3
Source File Reference UWIR11321