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2-{[4-allyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
SpectraBase Compound ID EUmzWEWzQ8S
InChI InChI=1S/C22H24N4O3S/c1-3-14-26-20(15-29-18-8-6-5-7-9-18)24-25-22(26)30-16-21(27)23-17-10-12-19(13-11-17)28-4-2/h3,5-13H,1,4,14-16H2,2H3,(H,23,27)
InChIKey NYGJROJUFSPTOP-UHFFFAOYSA-N
Mol Weight 424.52 g/mol
Molecular Formula C22H24N4O3S
Exact Mass 424.156912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7aMZAwvKRoY
Name 2-{[4-allyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)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/C22H24N4O3S/c1-3-14-26-20(15-29-18-8-6-5-7-9-18)24-25-22(26)30-16-21(27)23-17-10-12-19(13-11-17)28-4-2/h3,5-13H,1,4,14-16H2,2H3,(H,23,27)
InChIKey NYGJROJUFSPTOP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11497
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: E06407; Labnumber: GRES-22063; SBI_ID: SBI-011500
Temperature 308 °C