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N-{3-[(3-phenylpropyl)sulfanyl]-1H-1,2,4-triazol-5-yl}acetamide
SpectraBase Compound ID 5FPCXPs5pec
InChI InChI=1S/C13H16N4OS/c1-10(18)14-12-15-13(17-16-12)19-9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H2,14,15,16,17,18)
InChIKey JJAUBHJBEBPWNB-UHFFFAOYSA-N
Mol Weight 276.36 g/mol
Molecular Formula C13H16N4OS
Exact Mass 276.104482 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EQZIOegE8G7
Name N-{3-[(3-phenylpropyl)sulfanyl]-1H-1,2,4-triazol-5-yl}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/C13H16N4OS/c1-10(18)14-12-15-13(17-16-12)19-9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H2,14,15,16,17,18)
InChIKey JJAUBHJBEBPWNB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26627
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: D63685; Labnumber: TOLST-2265; SBI_ID: SBI-026631
Temperature 315 °C