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4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 4bSVue9dmdM
InChI InChI=1S/C15H9Cl2N5O2S/c16-12-6-5-10(22(23)24)7-9(12)8-18-21-14(19-20-15(21)25)11-3-1-2-4-13(11)17/h1-8H,(H,20,25)/b18-8+
InChIKey GWRKQDMVGVEIPG-QGMBQPNBSA-N
Mol Weight 394.24 g/mol
Molecular Formula C15H9Cl2N5O2S
Exact Mass 392.985401 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1w8vb6M1bLV
Name 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(2-chlorophenyl)-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/C15H9Cl2N5O2S/c16-12-6-5-10(22(23)24)7-9(12)8-18-21-14(19-20-15(21)25)11-3-1-2-4-13(11)17/h1-8H,(H,20,25)/b18-8+
InChIKey GWRKQDMVGVEIPG-QGMBQPNBSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16547
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: D24953; Labnumber: GRES-02970; SBI_ID: SBI-016550
Synonyms 4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2-chloro-5-nitrophenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C