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2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sec-butylphenyl)acetamide
SpectraBase Compound ID 9oWvPJrgGnP
InChI InChI=1S/C24H28N4OS/c1-5-14-28-23(20-9-7-8-17(3)15-20)26-27-24(28)30-16-22(29)25-21-12-10-19(11-13-21)18(4)6-2/h5,7-13,15,18H,1,6,14,16H2,2-4H3,(H,25,29)
InChIKey SMVGZSHFTFSLMB-UHFFFAOYSA-N
Mol Weight 420.58 g/mol
Molecular Formula C24H28N4OS
Exact Mass 420.198383 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D3GxfXMF6te
Name 2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sec-butylphenyl)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/C24H28N4OS/c1-5-14-28-23(20-9-7-8-17(3)15-20)26-27-24(28)30-16-22(29)25-21-12-10-19(11-13-21)18(4)6-2/h5,7-13,15,18H,1,6,14,16H2,2-4H3,(H,25,29)
InChIKey SMVGZSHFTFSLMB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11349
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: E06659; Labnumber: GRES-27003; SBI_ID: SBI-011352
Temperature 318 °C