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4-allyl-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

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4-allyl-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID B5eQ7EycPNB
InChI InChI=1S/C11H10ClN3S/c1-2-6-15-10(13-14-11(15)16)8-4-3-5-9(12)7-8/h2-5,7H,1,6H2,(H,14,16)
InChIKey WPVJPFLNVCGFQS-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 DoAPfFIj162
Name 4-allyl-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-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/C11H10ClN3S/c1-2-6-15-10(13-14-11(15)16)8-4-3-5-9(12)7-8/h2-5,7H,1,6H2,(H,14,16)
InChIKey WPVJPFLNVCGFQS-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_168
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: ZI/8024417; Labnumber: LP-0800699; IOH_ID: IOH-000169
Temperature 303 °C