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N-(3-fluoro-4-methylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID 9lHaV4XSbGw
InChI InChI=1S/C26H25FN4O3S/c1-17-4-10-22(11-5-17)34-15-24-29-30-26(31(24)20-8-12-21(33-3)13-9-20)35-16-25(32)28-19-7-6-18(2)23(27)14-19/h4-14H,15-16H2,1-3H3,(H,28,32)
InChIKey DAIMLXUSPKHOKH-UHFFFAOYSA-N
Mol Weight 492.57 g/mol
Molecular Formula C26H25FN4O3S
Exact Mass 492.16314 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6XjXmAJ0rcY
Name N-(3-fluoro-4-methylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-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/C26H25FN4O3S/c1-17-4-10-22(11-5-17)34-15-24-29-30-26(31(24)20-8-12-21(33-3)13-9-20)35-16-25(32)28-19-7-6-18(2)23(27)14-19/h4-14H,15-16H2,1-3H3,(H,28,32)
InChIKey DAIMLXUSPKHOKH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11064
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: E05732; Labnumber: GRES-09246; SBI_ID: SBI-011067
Temperature 318 °C