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2-{[4-allyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-tert-butylphenyl)acetamide
SpectraBase Compound ID 6CH2NSH5ENn
InChI InChI=1S/C24H28N4O2S/c1-6-15-28-22(17-11-7-10-14-20(17)30-5)26-27-23(28)31-16-21(29)25-19-13-9-8-12-18(19)24(2,3)4/h6-14H,1,15-16H2,2-5H3,(H,25,29)
InChIKey SJBUWGVOAJXJMA-UHFFFAOYSA-N
Mol Weight 436.57 g/mol
Molecular Formula C24H28N4O2S
Exact Mass 436.193297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A0Nyj73Brz0
Name 2-{[4-allyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-tert-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/C24H28N4O2S/c1-6-15-28-22(17-11-7-10-14-20(17)30-5)26-27-23(28)31-16-21(29)25-19-13-9-8-12-18(19)24(2,3)4/h6-14H,1,15-16H2,2-5H3,(H,25,29)
InChIKey SJBUWGVOAJXJMA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11375
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: E06693; Labnumber: GRES-27753; SBI_ID: SBI-011378
Temperature 318 °C