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3-benzyl-6-iodo-2-[(E)-2-(5-nitro-2-furyl)ethenyl]-4(3H)-quinazolinone
SpectraBase Compound ID KctRqUGpT5P
InChI InChI=1S/C21H14IN3O4/c22-15-6-9-18-17(12-15)21(26)24(13-14-4-2-1-3-5-14)19(23-18)10-7-16-8-11-20(29-16)25(27)28/h1-12H,13H2/b10-7+
InChIKey MJUXRJMDJIIBCC-JXMROGBWSA-N
Mol Weight 499.26 g/mol
Molecular Formula C21H14IN3O4
Exact Mass 499.002901 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BbMhr0jQDQG
Name 3-benzyl-6-iodo-2-[(E)-2-(5-nitro-2-furyl)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/C21H14IN3O4/c22-15-6-9-18-17(12-15)21(26)24(13-14-4-2-1-3-5-14)19(23-18)10-7-16-8-11-20(29-16)25(27)28/h1-12H,13H2/b10-7+
InChIKey MJUXRJMDJIIBCC-JXMROGBWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10353
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: 136444; Labnumber: AENIC7-453; VK_ID: VK-010357
Synonyms 3-benzyl-6-iodo-2-[2-(5-nitro-2-furyl)ethenyl]-4(3H)-quinazolinone
Temperature 318 °C