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butanamide, N-(3-acetylphenyl)-4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-
SpectraBase Compound ID IbbY8jlMLhr
InChI InChI=1S/C20H18F3N3O2S/c1-12-9-17(20(21,22)23)16(11-24)19(25-12)29-8-4-7-18(28)26-15-6-3-5-14(10-15)13(2)27/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,26,28)
InChIKey ZXCMZRJQKQVLJY-UHFFFAOYSA-N
Mol Weight 421.44 g/mol
Molecular Formula C20H18F3N3O2S
Exact Mass 421.107182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ADG7EQMW9uG
Name butanamide, N-(3-acetylphenyl)-4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-
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/C20H18F3N3O2S/c1-12-9-17(20(21,22)23)16(11-24)19(25-12)29-8-4-7-18(28)26-15-6-3-5-14(10-15)13(2)27/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,26,28)
InChIKey ZXCMZRJQKQVLJY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1628
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: F12039; Labnumber: GOR-S1034-0018