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ethanone, 2-[[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-
SpectraBase Compound ID 5jfFxySUBQD
InChI InChI=1S/C22H28N4O3S/c1-6-25-21(17-7-9-18(29-5)10-8-17)23-24-22(25)30-14-20(27)19-13-15(2)26(16(19)3)11-12-28-4/h7-10,13H,6,11-12,14H2,1-5H3
InChIKey SZLSKBCWQHKCEA-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C22H28N4O3S
Exact Mass 428.188212 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GXvHxOnh6IM
Name ethanone, 2-[[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-
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/C22H28N4O3S/c1-6-25-21(17-7-9-18(29-5)10-8-17)23-24-22(25)30-14-20(27)19-13-15(2)26(16(19)3)11-12-28-4/h7-10,13H,6,11-12,14H2,1-5H3
InChIKey SZLSKBCWQHKCEA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5159
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: F24548; Labnumber: ALEKS1-29237