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

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4-butyl-5-(1,3-dimethyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 42KOL2yj0ZX
InChI InChI=1S/C11H17N5S/c1-4-5-6-16-10(12-13-11(16)17)9-7-8(2)14-15(9)3/h7H,4-6H2,1-3H3,(H,13,17)
InChIKey RSETUGHLCMWXKU-UHFFFAOYSA-N
Mol Weight 251.35 g/mol
Molecular Formula C11H17N5S
Exact Mass 251.120467 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HzQsjzcgpvj
Name 4-butyl-5-(1,3-dimethyl-1H-pyrazol-5-yl)-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/C11H17N5S/c1-4-5-6-16-10(12-13-11(16)17)9-7-8(2)14-15(9)3/h7H,4-6H2,1-3H3,(H,13,17)
InChIKey RSETUGHLCMWXKU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14322
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/1013834; UBI_ID: UBI-014325
Synonyms 4-butyl-5-(1,3-dimethyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C