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4-{[(E,2E)-3-(2-furyl)-2-propenylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID 3OWICjhNMh
InChI InChI=1S/C13H12N6OS/c1-9-8-11(16-15-9)12-17-18-13(21)19(12)14-6-2-4-10-5-3-7-20-10/h2-8H,1H3,(H,15,16)(H,18,21)/b4-2+,14-6+
InChIKey XMUNOEDGXUCLNR-FMDPHQNASA-N
Mol Weight 300.34 g/mol
Molecular Formula C13H12N6OS
Exact Mass 300.07933 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5BKwqscpUkC
Name 4-{[(E,2E)-3-(2-furyl)-2-propenylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
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/C13H12N6OS/c1-9-8-11(16-15-9)12-17-18-13(21)19(12)14-6-2-4-10-5-3-7-20-10/h2-8H,1H3,(H,15,16)(H,18,21)/b4-2+,14-6+
InChIKey XMUNOEDGXUCLNR-FMDPHQNASA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10565
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: E00651; Labnumber: GRES-19968; SBI_ID: SBI-010568
Synonyms 4-{[(E,2E)-3-(2-furyl)-2-propenylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol4-{[3-(2-furyl)-2-propenylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C