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5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol

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5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID IoWilfD9l9c
InChI InChI=1S/C13H12FN5S/c1-8-7-11(18(2)17-8)12-15-16-13(20)19(12)10-5-3-9(14)4-6-10/h3-7H,1-2H3,(H,16,20)
InChIKey VUUARHLAEGVLKI-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C13H12FN5S
Exact Mass 289.079745 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID pfJCSypdY4
Name 5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazole-3-thiol
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/C13H12FN5S/c1-8-7-11(18(2)17-8)12-15-16-13(20)19(12)10-5-3-9(14)4-6-10/h3-7H,1-2H3,(H,16,20)
InChIKey VUUARHLAEGVLKI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12842
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: UZI/1010123; UBI_ID: UBI-012845
Synonyms 5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C