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N-(4-bromophenyl)-2-[(3-cyano-4-isopropyl-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl)sulfanyl]acetamide
SpectraBase Compound ID 1EAK5gEVBx5
InChI InChI=1S/C17H18BrN3O2S/c1-10(2)13-7-15(22)21-17(14(13)8-19)24-9-16(23)20-12-5-3-11(18)4-6-12/h3-6,10,13H,7,9H2,1-2H3,(H,20,23)(H,21,22)
InChIKey MNLCOCZNADTZDN-UHFFFAOYSA-N
Mol Weight 408.31 g/mol
Molecular Formula C17H18BrN3O2S
Exact Mass 407.030311 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6a4atibiEWX
Name N-(4-bromophenyl)-2-[(3-cyano-4-isopropyl-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl)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/C17H18BrN3O2S/c1-10(2)13-7-15(22)21-17(14(13)8-19)24-9-16(23)20-12-5-3-11(18)4-6-12/h3-6,10,13H,7,9H2,1-2H3,(H,20,23)(H,21,22)
InChIKey MNLCOCZNADTZDN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1810
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: NMR/9253193; Labnumber: KR-0000046
Temperature 303 °C