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benzonitrile, 3-chloro-4-[[[4-methyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-
SpectraBase Compound ID 7seWXUsQYtR
InChI InChI=1S/C18H15ClN4S/c1-23-17(10-13-5-3-2-4-6-13)21-22-18(23)24-12-15-8-7-14(11-20)9-16(15)19/h2-9H,10,12H2,1H3
InChIKey FEFIUJFMLVDIBA-UHFFFAOYSA-N
Mol Weight 354.86 g/mol
Molecular Formula C18H15ClN4S
Exact Mass 354.070595 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G7BkH02fQbn
Name benzonitrile, 3-chloro-4-[[[4-methyl-5-(phenylmethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-
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/C18H15ClN4S/c1-23-17(10-13-5-3-2-4-6-13)21-22-18(23)24-12-15-8-7-14(11-20)9-16(15)19/h2-9H,10,12H2,1H3
InChIKey FEFIUJFMLVDIBA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_504
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/8325819; Labnumber: LP-0502107
Temperature 303 °C