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2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

View entire compound with spectra: 1 NMR

2-{[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID LPFnU8IbvhI
InChI InChI=1S/C14H16N4OS/c1-3-7-18-13(11-6-4-5-10(2)8-11)16-17-14(18)20-9-12(15)19/h3-6,8H,1,7,9H2,2H3,(H2,15,19)
InChIKey IWCGCCITDSECBN-UHFFFAOYSA-N
Mol Weight 288.37 g/mol
Molecular Formula C14H16N4OS
Exact Mass 288.104482 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6L8hK5HDnEZ
Name 2-{[4-allyl-5-(3-methylphenyl)-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/C14H16N4OS/c1-3-7-18-13(11-6-4-5-10(2)8-11)16-17-14(18)20-9-12(15)19/h3-6,8H,1,7,9H2,2H3,(H2,15,19)
InChIKey IWCGCCITDSECBN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11113
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: E06104; Labnumber: GRES-16153; SBI_ID: SBI-011116
Temperature 306 °C