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MIXTURE

View entire compound with spectra: 2 NMR

MIXTURE
SpectraBase Compound ID F8hidsg9buA
InChI InChI=1S/2C13H11BrF3NO5/c2*1-22-11(20)9(12(21)23-6-13(15,16)17)10(19)18-8-4-2-7(14)3-5-8/h2-5,18-19H,6H2,1H3;2-5,9H,6H2,1H3,(H,18,19)/b10-9-;
InChIKey IRCZFFHDDCABPZ-KVVVOXFISA-N
Mol Weight 398.13 g/mol
Molecular Formula C13H11BrF3NO5
Exact Mass 396.97727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID R3hzXrH0Z5
Name MIXTURE;SOLID-STATE
Compound Number 7C/8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11BrF3NO5
InChI InChI=1S/2C13H11BrF3NO5/c2*1-22-11(20)9(12(21)23-6-13(15,16)17)10(19)18-8-4-2-7(14)3-5-8/h2-5,18-19H,6H2,1H3;2-5,9H,6H2,1H3,(H,18,19)/b10-9-;
InChIKey IRCZFFHDDCABPZ-KVVVOXFISA-N
Literature Reference Author Y.X.LEI,G.CERIONI,Z.RAPPOPORT
Literature Reference Citation J.ORG.CHEM.,66,8379(2001)
Literature Reference DOI 10.1021/jo010487+
Molecular Weight 398.133 g/mol
Solvent Unknown
Source File Reference UWLU29215