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1-(4-fluorophenyl)-4-methyl-2-pentyne-1,4-diol
SpectraBase Compound ID 2XcNoQI9pBc
InChI InChI=1S/C12H13FO2/c1-12(2,15)8-7-11(14)9-3-5-10(13)6-4-9/h3-6,11,14-15H,1-2H3
InChIKey MAVDLEIBAXDPQJ-UHFFFAOYSA-N
Mol Weight 208.23 g/mol
Molecular Formula C12H13FO2
Exact Mass 208.089958 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9KUMzirrD1a
Name 1-(4-fluorophenyl)-4-methyl-2-pentyne-1,4-diol
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H13FO2/c1-12(2,15)8-7-11(14)9-3-5-10(13)6-4-9/h3-6,11,14-15H,1-2H3
InChIKey MAVDLEIBAXDPQJ-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_515
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/8045961; Labnumber: L-05/0000572; IOH_ID: IOH-000516
Temperature 297 °C