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4-(4-methoxyphenyl)-5-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID JMV0t2f2dCM
InChI InChI=1S/C14H14N6O3S/c1-9-7-12(20(21)22)17-18(9)8-13-15-16-14(24)19(13)10-3-5-11(23-2)6-4-10/h3-7H,8H2,1-2H3,(H,16,24)
InChIKey WPNSTJYFFUIKQV-UHFFFAOYSA-N
Mol Weight 346.37 g/mol
Molecular Formula C14H14N6O3S
Exact Mass 346.08481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JGPHeEgsCF
Name 4-(4-methoxyphenyl)-5-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-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/C14H14N6O3S/c1-9-7-12(20(21)22)17-18(9)8-13-15-16-14(24)19(13)10-3-5-11(23-2)6-4-10/h3-7H,8H2,1-2H3,(H,16,24)
InChIKey WPNSTJYFFUIKQV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10583
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/1026473; Labnumber: KUZ0296; UZI_ID: UZI-010585
Synonyms 4-(4-methoxyphenyl)-5-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C