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(2E)-2-(1,3-benzothiazol-2-yl)-3-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-2-propenenitrile
SpectraBase Compound ID 57GsMbcE5Ug
InChI InChI=1S/C23H14BrClN2OS/c24-18-7-10-21(28-14-15-5-8-19(25)9-6-15)16(12-18)11-17(13-26)23-27-20-3-1-2-4-22(20)29-23/h1-12H,14H2/b17-11+
InChIKey XGIDTUUYYJNSLC-GZTJUZNOSA-N
Mol Weight 481.8 g/mol
Molecular Formula C23H14BrClN2OS
Exact Mass 479.969875 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Au1ecKaNPQe
Name (2E)-2-(1,3-benzothiazol-2-yl)-3-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-2-propenenitrile
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/C23H14BrClN2OS/c24-18-7-10-21(28-14-15-5-8-19(25)9-6-15)16(12-18)11-17(13-26)23-27-20-3-1-2-4-22(20)29-23/h1-12H,14H2/b17-11+
InChIKey XGIDTUUYYJNSLC-GZTJUZNOSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11078
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: UZI/1009880; UBI_ID: UBI-011081
Synonyms 2-(1,3-benzothiazol-2-yl)-3-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-2-propenenitrile
Temperature 315 °C