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4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide

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4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID FyPjgF47hxt
InChI InChI=1S/C11H10ClN3S/c1-2-7-15-10(13-14-11(15)16)8-5-3-4-6-9(8)12/h2-6H,1,7H2,(H,14,16)
InChIKey PDCUSSPUBSHCDY-UHFFFAOYSA-N
Mol Weight 251.73 g/mol
Molecular Formula C11H10ClN3S
Exact Mass 251.028396 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 89uUGEQvXbY
Name 4-allyl-5-(2-chlorophenyl)-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/C11H10ClN3S/c1-2-7-15-10(13-14-11(15)16)8-5-3-4-6-9(8)12/h2-6H,1,7H2,(H,14,16)
InChIKey PDCUSSPUBSHCDY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12420
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: 100257; Labnumber: BAD8-0033; VK_ID: VK-012425
Synonyms 4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C