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2-(4-chlorophenyl)-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione

View entire compound with spectra: 1 NMR

2-(4-chlorophenyl)-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione
SpectraBase Compound ID Hnd8mByswlO
InChI InChI=1S/C13H18ClN3S/c1-9(2)8-13(3)15-12(18)17(16-13)11-6-4-10(14)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,15,18)
InChIKey OMICCYZZXIQVSP-UHFFFAOYSA-N
Mol Weight 283.82 g/mol
Molecular Formula C13H18ClN3S
Exact Mass 283.090996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1CZ9Fac2aqc
Name 2-(4-chlorophenyl)-5-isobutyl-5-methyl-1,2,4-triazolidine-3-thione
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/C13H18ClN3S/c1-9(2)8-13(3)15-12(18)17(16-13)11-6-4-10(14)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,15,18)
InChIKey OMICCYZZXIQVSP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12180
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: 1000256; UBI_ID: UBI-012183
Temperature 318 °C