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MAJOR-ISOMER

View entire compound with spectra: 2 NMR

MAJOR-ISOMER
SpectraBase Compound ID 2ESN69yq2mC
InChI InChI=1S/C26H25F3O4/c1-31-25(26(27,28)29,22-15-9-4-10-16-22)24(30)33-23(21-13-7-3-8-14-21)17-18-32-19-20-11-5-2-6-12-20/h2-16,23H,17-19H2,1H3/t23-,25?/m0/s1
InChIKey NJJCXWCQOXSFAN-LFQPHHBNSA-N
Mol Weight 458.48 g/mol
Molecular Formula C26H25F3O4
Exact Mass 458.170494 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GnJaVHyPQar
Name MAJOR-ISOMER
Compound Number 5N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H25F3O4
InChI InChI=1S/C26H25F3O4/c1-31-25(26(27,28)29,22-15-9-4-10-16-22)24(30)33-23(21-13-7-3-8-14-21)17-18-32-19-20-11-5-2-6-12-20/h2-16,23H,17-19H2,1H3/t23-,25?/m0/s1
InChIKey NJJCXWCQOXSFAN-LFQPHHBNSA-N
Literature Reference Author T.HAYASHI,S.HIRATE,K.KITAYAMA,H.TSUJI,A.TORII,Y.UOZUMI
Literature Reference Citation J.ORG.CHEM.,66,1441(2001)
Literature Reference DOI 10.1021/jo001614p
Solvent CDCl3
Source File Reference UWMS25943