3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(2-methyl-1H-indol-3-yl)ethenyl]-4(3H)-quinazolinone

SpectraBase Compound ID	9LBsOP8FfnC
InChI	InChI=1S/C22H20IN3O2/c1-14-16(17-5-2-3-6-19(17)24-14)8-10-21-25-20-9-7-15(23)13-18(20)22(28)26(21)11-4-12-27/h2-3,5-10,13,24,27H,4,11-12H2,1H3/b10-8+
InChIKey	XBOCAQGJOBUZCJ-CSKARUKUSA-N Google Search
Mol Weight	485.33 g/mol
Molecular Formula	C22H20IN3O2
Exact Mass	485.060022 g/mol

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SpectraBase Spectrum ID	2RUSOeDdurT
Name	3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(2-methyl-1H-indol-3-yl)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/C22H20IN3O2/c1-14-16(17-5-2-3-6-19(17)24-14)8-10-21-25-20-9-7-15(23)13-18(20)22(28)26(21)11-4-12-27/h2-3,5-10,13,24,27H,4,11-12H2,1H3/b10-8+
InChIKey	XBOCAQGJOBUZCJ-CSKARUKUSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_14187
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: D97007; Labnumber: AMIR2-5633; SBI_ID: SBI-014190
Synonyms	3-(3-hydroxypropyl)-6-iodo-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-4(3H)-quinazolinone
Temperature	318 °C