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4-(3,5-Bis[trifluoromethyl-phenyl]-pent-2-yn-4-ol

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4-(3,5-Bis[trifluoromethyl-phenyl]-pent-2-yn-4-ol
SpectraBase Compound ID HQo7HQ7zxpE
InChI InChI=1S/C13H10F6O/c1-3-4-11(2,20)8-5-9(12(14,15)16)7-10(6-8)13(17,18)19/h5-7,20H,1-2H3
InChIKey OARJBRDWSDPNHX-UHFFFAOYSA-N
Mol Weight 296.21 g/mol
Molecular Formula C13H10F6O
Exact Mass 296.063584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I35qLiWUwoX
Name 4-(3,5-Bis[trifluoromethyl-phenyl]-pent-2-yn-4-ol
CAS Registry Number 96307-89-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H10F6O
InChI InChI=1S/C13H10F6O/c1-3-4-11(2,20)8-5-9(12(14,15)16)7-10(6-8)13(17,18)19/h5-7,20H,1-2H3
InChIKey OARJBRDWSDPNHX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G.K. Prakash, V.V. Krishnamurthy, G.Olah, J. Am. Chem. Soc. 107, 3928 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3