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3-(4-bromophenyl)-6-iodo-2-[(E)-2-(3-pyridinyl)ethenyl]-4(3H)-quinazolinone
SpectraBase Compound ID 7520cvdtig2
InChI InChI=1S/C21H13BrIN3O/c22-15-4-7-17(8-5-15)26-20(10-3-14-2-1-11-24-13-14)25-19-9-6-16(23)12-18(19)21(26)27/h1-13H/b10-3+
InChIKey LGBITOMZBMDSGD-XCVCLJGOSA-N
Mol Weight 530.16 g/mol
Molecular Formula C21H13BrIN3O
Exact Mass 528.92867 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HiJEbwr9dEs
Name 3-(4-bromophenyl)-6-iodo-2-[(E)-2-(3-pyridinyl)ethenyl]-4(3H)-quinazolinone
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/C21H13BrIN3O/c22-15-4-7-17(8-5-15)26-20(10-3-14-2-1-11-24-13-14)25-19-9-6-16(23)12-18(19)21(26)27/h1-13H/b10-3+
InChIKey LGBITOMZBMDSGD-XCVCLJGOSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1045
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: C94963; Labnumber: AENIC71-0113; SBI_ID: SBI-001047
Synonyms 3-(4-bromophenyl)-6-iodo-2-[2-(3-pyridinyl)ethenyl]-4(3H)-quinazolinone
Temperature 308 °C