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2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Lc8K109Zkll
InChI InChI=1S/C18H19N5OS/c1-13-7-9-14(10-8-13)20-11-17-21-22-18(25-12-16(19)24)23(17)15-5-3-2-4-6-15/h2-10,20H,11-12H2,1H3,(H2,19,24)
InChIKey NACBPWUDWMVORE-UHFFFAOYSA-N
Mol Weight 353.44 g/mol
Molecular Formula C18H19N5OS
Exact Mass 353.131031 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4jGACzKcwN5
Name 2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C18H19N5OS/c1-13-7-9-14(10-8-13)20-11-17-21-22-18(25-12-16(19)24)23(17)15-5-3-2-4-6-15/h2-10,20H,11-12H2,1H3,(H2,19,24)
InChIKey NACBPWUDWMVORE-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18106
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: UZI/8081234; Labnumber: STA-0005696; UZI_ID: UZI-018113
Temperature 308 °C