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N-{5-[(3-acetyl-2,4,6-trimethylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide
SpectraBase Compound ID AyiEnqYHvAn
InChI InChI=1S/C22H23N3O3S2/c1-12-10-13(2)19(15(4)26)14(3)17(12)11-29-22-25-24-21(30-22)23-20(27)16-8-6-7-9-18(16)28-5/h6-10H,11H2,1-5H3,(H,23,24,27)
InChIKey ODXDBJCPLKYSMO-UHFFFAOYSA-N
Mol Weight 441.56 g/mol
Molecular Formula C22H23N3O3S2
Exact Mass 441.118084 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KKM2qDdtHiW
Name N-{5-[(3-acetyl-2,4,6-trimethylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-methoxybenzamide
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/C22H23N3O3S2/c1-12-10-13(2)19(15(4)26)14(3)17(12)11-29-22-25-24-21(30-22)23-20(27)16-8-6-7-9-18(16)28-5/h6-10H,11H2,1-5H3,(H,23,24,27)
InChIKey ODXDBJCPLKYSMO-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3016
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: D06414; Labnumber: SPKOL-4240; SBI_ID: SBI-003018
Temperature 306 °C