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3-[(4-bromobenzyl)sulfanyl]-4-ethyl-5-phenyl-4H-1,2,4-triazole
SpectraBase Compound ID AzeRl3Hf1cW
InChI InChI=1S/C17H16BrN3S/c1-2-21-16(14-6-4-3-5-7-14)19-20-17(21)22-12-13-8-10-15(18)11-9-13/h3-11H,2,12H2,1H3
InChIKey SPEZBELASPIKEI-UHFFFAOYSA-N
Mol Weight 374.3 g/mol
Molecular Formula C17H16BrN3S
Exact Mass 373.024832 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID YQ7ADCpymR
Name 3-[(4-bromobenzyl)sulfanyl]-4-ethyl-5-phenyl-4H-1,2,4-triazole
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/C17H16BrN3S/c1-2-21-16(14-6-4-3-5-7-14)19-20-17(21)22-12-13-8-10-15(18)11-9-13/h3-11H,2,12H2,1H3
InChIKey SPEZBELASPIKEI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14492
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: D98600; Labnumber: GRES-23434; SBI_ID: SBI-014495
Synonyms 4-bromobenzyl 4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl sulfide
Temperature 308 °C