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4-bromo-N-{2,2,2-trichloro-1-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)amino]ethyl}benzamide
SpectraBase Compound ID BWxC6WswBhN
InChI InChI=1S/C17H13BrCl3N3OS/c18-10-6-4-9(5-7-10)14(25)23-16(17(19,20)21)24-15-12(8-22)11-2-1-3-13(11)26-15/h4-7,16,24H,1-3H2,(H,23,25)
InChIKey ZUCYFFBRXUUHPW-UHFFFAOYSA-N
Mol Weight 493.63 g/mol
Molecular Formula C17H13BrCl3N3OS
Exact Mass 490.902829 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DPamQ65P9X
Name 4-bromo-N-{2,2,2-trichloro-1-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)amino]ethyl}benzamide
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/C17H13BrCl3N3OS/c18-10-6-4-9(5-7-10)14(25)23-16(17(19,20)21)24-15-12(8-22)11-2-1-3-13(11)26-15/h4-7,16,24H,1-3H2,(H,23,25)
InChIKey ZUCYFFBRXUUHPW-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_14953
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: 987/00001072; Labnumber: 987/00001072218812; VK_ID: VK-014958
Temperature 305 °C