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2-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-6-iodo-3-(2-phenylethyl)-4(3H)-quinazolinone
SpectraBase Compound ID 6uUHbrN1JVM
InChI InChI=1S/C25H21IN2O3/c1-31-23-15-18(7-11-22(23)29)8-12-24-27-21-10-9-19(26)16-20(21)25(30)28(24)14-13-17-5-3-2-4-6-17/h2-12,15-16,29H,13-14H2,1H3/b12-8+
InChIKey CDTYQIWEWIJJBN-XYOKQWHBSA-N
Mol Weight 524.36 g/mol
Molecular Formula C25H21IN2O3
Exact Mass 524.059688 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ChJC9lhBEu
Name 2-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-6-iodo-3-(2-phenylethyl)-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/C25H21IN2O3/c1-31-23-15-18(7-11-22(23)29)8-12-24-27-21-10-9-19(26)16-20(21)25(30)28(24)14-13-17-5-3-2-4-6-17/h2-12,15-16,29H,13-14H2,1H3/b12-8+
InChIKey CDTYQIWEWIJJBN-XYOKQWHBSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1041
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: C94957; Labnumber: AENIC71-0088; SBI_ID: SBI-001043
Synonyms 2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-6-iodo-3-(2-phenylethyl)-4(3H)-quinazolinone
Temperature 308 °C