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3-(methylsulfanyl)-4,5-diphenyl-4H-1,2,4-triazole

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3-(methylsulfanyl)-4,5-diphenyl-4H-1,2,4-triazole
SpectraBase Compound ID 7PmBOoAorpA
InChI InChI=1S/C15H13N3S/c1-19-15-17-16-14(12-8-4-2-5-9-12)18(15)13-10-6-3-7-11-13/h2-11H,1H3
InChIKey PAKRAHUFFMXUFR-UHFFFAOYSA-N
Mol Weight 267.35 g/mol
Molecular Formula C15H13N3S
Exact Mass 267.083019 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cb5ieh4HmPi
Name 3-(methylsulfanyl)-4,5-diphenyl-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/C15H13N3S/c1-19-15-17-16-14(12-8-4-2-5-9-12)18(15)13-10-6-3-7-11-13/h2-11H,1H3
InChIKey PAKRAHUFFMXUFR-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7474
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: D29857; Labnumber: SPPOL-3650; SBI_ID: SBI-007477
Synonyms 4,5-diphenyl-4H-1,2,4-triazol-3-yl methyl sulfide
Temperature 308 °C