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N-(2-bromo-4,6-difluorophenyl)-2-({4-(2-furylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

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N-(2-bromo-4,6-difluorophenyl)-2-({4-(2-furylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID 2UBMvjPLFHH
InChI InChI=1S/C23H19BrF2N4O3S/c1-14-4-6-16(7-5-14)33-12-20-28-29-23(30(20)11-17-3-2-8-32-17)34-13-21(31)27-22-18(24)9-15(25)10-19(22)26/h2-10H,11-13H2,1H3,(H,27,31)
InChIKey RLXSUMBNWWDURX-UHFFFAOYSA-N
Mol Weight 549.39 g/mol
Molecular Formula C23H19BrF2N4O3S
Exact Mass 548.032931 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2bHBGsdHNdH
Name N-(2-bromo-4,6-difluorophenyl)-2-({4-(2-furylmethyl)-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/C23H19BrF2N4O3S/c1-14-4-6-16(7-5-14)33-12-20-28-29-23(30(20)11-17-3-2-8-32-17)34-13-21(31)27-22-18(24)9-15(25)10-19(22)26/h2-10H,11-13H2,1H3,(H,27,31)
InChIKey RLXSUMBNWWDURX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11245
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: E06529; Labnumber: GRES-24181; SBI_ID: SBI-011248
Temperature 315 °C