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4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 NMR

4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 3XRKRebx1zJ
InChI InChI=1S/C15H19N3S/c1-5-10-18-13(16-17-14(18)19)11-6-8-12(9-7-11)15(2,3)4/h5-9H,1,10H2,2-4H3,(H,17,19)
InChIKey DWHZDECQMUUDJV-UHFFFAOYSA-N
Mol Weight 273.4 g/mol
Molecular Formula C15H19N3S
Exact Mass 273.129969 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DtMI28bG07r
Name 4-allyl-5-(4-tert-butylphenyl)-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/C15H19N3S/c1-5-10-18-13(16-17-14(18)19)11-6-8-12(9-7-11)15(2,3)4/h5-9H,1,10H2,2-4H3,(H,17,19)
InChIKey DWHZDECQMUUDJV-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16080
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: 987/00003160; Labnumber: 987/00003160218838; VK_ID: VK-016085
Synonyms 4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C