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2-{[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
SpectraBase Compound ID 9WdMC6G4oAX
InChI InChI=1S/C19H17Br2ClN4OS/c1-3-26-18(12-6-4-5-7-15(12)22)24-25-19(26)28-10-16(27)23-17-13(20)8-11(2)9-14(17)21/h4-9H,3,10H2,1-2H3,(H,23,27)
InChIKey FJVREXHLLFNRIU-UHFFFAOYSA-N
Mol Weight 544.69 g/mol
Molecular Formula C19H17Br2ClN4OS
Exact Mass 541.917836 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BV6DQOfLJwP
Name 2-{[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)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/C19H17Br2ClN4OS/c1-3-26-18(12-6-4-5-7-15(12)22)24-25-19(26)28-10-16(27)23-17-13(20)8-11(2)9-14(17)21/h4-9H,3,10H2,1-2H3,(H,23,27)
InChIKey FJVREXHLLFNRIU-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4080
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: D98530; Labnumber: GRES-22377; SBI_ID: SBI-004082
Temperature 318 °C