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

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4-allyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID 86VxvNi9vTo
InChI InChI=1S/C12H13N3S/c1-3-8-15-11(13-14-12(15)16)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,14,16)
InChIKey ZHSGDTYCPUCKAU-UHFFFAOYSA-N
Mol Weight 231.32 g/mol
Molecular Formula C12H13N3S
Exact Mass 231.083019 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 73yeq7zFdib
Name 4-allyl-5-(4-methylphenyl)-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/C12H13N3S/c1-3-8-15-11(13-14-12(15)16)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,14,16)
InChIKey ZHSGDTYCPUCKAU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14384
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: D98353; Labnumber: GRES-19700; SBI_ID: SBI-014387
Synonyms 4-allyl-5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C