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MAJOR-ISOMER
SpectraBase Compound ID 3cQ8cZaeKqa
InChI InChI=1S/C30H16F8/c31-27(32)15-9-11-16(12-10-15)28(33,34)30(37,38)22-14-13-21(29(27,35)36)25-23-17-5-1-2-6-18(17)24(26(22)25)20-8-4-3-7-19(20)23/h1-14,23-24H/t23-,24+
InChIKey DOCCBYPDLUDZTA-PSWAGMNNSA-N
Mol Weight 528.45 g/mol
Molecular Formula C30H16F8
Exact Mass 528.112426 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1pBvr1SWJ0e
Name MINOR-ISOMER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H16F8
InChI InChI=1S/C30H16F8/c31-27(32)15-9-11-16(12-10-15)28(33,34)30(37,38)22-14-13-21(29(27,35)36)25-23-17-5-1-2-6-18(17)24(26(22)25)20-8-4-3-7-19(20)23/h1-14,23-24H/t23-,24+
InChIKey DOCCBYPDLUDZTA-PSWAGMNNSA-N
Literature Reference Author M.A.BATTISTE,J.X.DUAN,Y.A.ZHAI,I.GHIVIRIGA,K.A.ABBOUD,W.R.DO LBIER
Literature Reference Citation J.ORG.CHEM.,68,3078(2003)
Literature Reference DOI 10.1021/jo0268815
Solvent CDCl3
Source File Reference UWSI22935