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2-(2'-AMINO-5'-CHLOROPHENYL)-1,1,1-TRIFLUORO-4-PHENYLBUT-3-YN-2-OL
SpectraBase Compound ID 1pLu1xpySZl
InChI InChI=1S/2C16H11ClF3NO/c2*17-12-6-7-14(21)13(10-12)15(22,16(18,19)20)9-8-11-4-2-1-3-5-11/h2*1-7,10,22H,21H2/t2*15-/m10/s1
InChIKey VIZZMRJHNKJROW-ZWZQDMJTSA-N
Mol Weight 651.44 g/mol
Molecular Formula C32H22Cl2F6N2O2
Exact Mass 650.096252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7kaefD8IDTT
Name 2-(2'-AMINO-5'-CHLOROPHENYL)-1,1,1-TRIFLUORO-4-PHENYLBUT-3-YN-2-OL
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H22Cl2F6N2O2
InChI InChI=1S/2C16H11ClF3NO/c2*17-12-6-7-14(21)13(10-12)15(22,16(18,19)20)9-8-11-4-2-1-3-5-11/h2*1-7,10,22H,21H2/t2*15-/m10/s1
InChIKey VIZZMRJHNKJROW-ZWZQDMJTSA-N
Literature Reference Author B.JIANG,Y.G.SI
Literature Reference Citation J.ORG.CHEM.,67,9449(2002)
Literature Reference DOI 10.1021/jo0204606
Molecular Weight 651.435 g/mol
Solvent ACETONE-D6
Source File Reference UWMS25365