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2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-sec-butylphenyl)acetamide
SpectraBase Compound ID BMd0Wyxw9Xt
InChI InChI=1S/C24H28N4O2S/c1-5-15-28-23(19-9-13-21(30-4)14-10-19)26-27-24(28)31-16-22(29)25-20-11-7-18(8-12-20)17(3)6-2/h5,7-14,17H,1,6,15-16H2,2-4H3,(H,25,29)
InChIKey GCLOHTQTTGDKKA-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 CC79vrrrtLb
Name 2-{[4-allyl-5-(4-methoxyphenyl)-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/C24H28N4O2S/c1-5-15-28-23(19-9-13-21(30-4)14-10-19)26-27-24(28)31-16-22(29)25-20-11-7-18(8-12-20)17(3)6-2/h5,7-14,17H,1,6,15-16H2,2-4H3,(H,25,29)
InChIKey GCLOHTQTTGDKKA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4408
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: D98960; Labnumber: GRES-29139; SBI_ID: SBI-004410
Temperature 308 °C