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4H-1,2,4-triazole-3-thiol, 4-(4-chlorophenyl)-5-(1-methylethyl)-

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 4-(4-chlorophenyl)-5-(1-methylethyl)-
SpectraBase Compound ID HmAnNKbMW6G
InChI InChI=1S/C11H12ClN3S/c1-7(2)10-13-14-11(16)15(10)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,14,16)
InChIKey ZVYYKEHYQQVLIU-UHFFFAOYSA-N
Mol Weight 253.75 g/mol
Molecular Formula C11H12ClN3S
Exact Mass 253.044046 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CiICknxHR9n
Name 4H-1,2,4-triazole-3-thiol, 4-(4-chlorophenyl)-5-(1-methylethyl)-
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/C11H12ClN3S/c1-7(2)10-13-14-11(16)15(10)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,14,16)
InChIKey ZVYYKEHYQQVLIU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3549
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: NMR/17217289; Labnumber: OBK-7935