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QRLWWPJMKNLXRX-UOQXYWCXSA-N
SpectraBase Compound ID IMJDndn1p7y
InChI InChI=1S/C13H8F6N2O3.C6H15N/c14-12(15,16)11(13(17,18)19)24-10(23)8(6-20)9(22)21-7-4-2-1-3-5-7;1-4-7(5-2)6-3/h1-5,11,21-22H;4-6H2,1-3H3/b9-8-;
InChIKey QRLWWPJMKNLXRX-UOQXYWCXSA-N
Mol Weight 455.4 g/mol
Molecular Formula C19H23F6N3O3
Exact Mass 455.164361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Haa3BwNdmsL
Name QRLWWPJMKNLXRX-UOQXYWCXSA-N
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23F6N3O3
InChI InChI=1S/C13H8F6N2O3.C6H15N/c14-12(15,16)11(13(17,18)19)24-10(23)8(6-20)9(22)21-7-4-2-1-3-5-7;1-4-7(5-2)6-3/h1-5,11,21-22H;4-6H2,1-3H3/b9-8-;
InChIKey QRLWWPJMKNLXRX-UOQXYWCXSA-N
Literature Reference Author Y.X.LEI,D.CASARINI,G.CERIONI,Z.RAPPOPORT
Literature Reference Citation J.ORG.CHEM.,68,947(2003)
Literature Reference DOI 10.1021/jo020464a
Molecular Weight 455.400 g/mol
Solvent THF-D8
Source File Reference UWLU22835