3-benzyl-2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-6-iodo-4(3H)-quinazolinone

SpectraBase Compound ID	ETVLnp7Qs0F
InChI	InChI=1S/C27H22IN3O/c1-18-21(22-10-6-7-11-25(22)30(18)2)13-15-26-29-24-14-12-20(28)16-23(24)27(32)31(26)17-19-8-4-3-5-9-19/h3-16H,17H2,1-2H3/b15-13+
InChIKey	QXFDQCYSEHLKLI-FYWRMAATSA-N Google Search
Mol Weight	531.4 g/mol
Molecular Formula	C27H22IN3O
Exact Mass	531.080757 g/mol

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SpectraBase Spectrum ID	9RLGTKcqaf0
Name	3-benzyl-2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-6-iodo-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/C27H22IN3O/c1-18-21(22-10-6-7-11-25(22)30(18)2)13-15-26-29-24-14-12-20(28)16-23(24)27(32)31(26)17-19-8-4-3-5-9-19/h3-16H,17H2,1-2H3/b15-13+
InChIKey	QXFDQCYSEHLKLI-FYWRMAATSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_10347
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: 136435; Labnumber: AENIC7-442; VK_ID: VK-010351
Synonyms	3-benzyl-2-[2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-6-iodo-4(3H)-quinazolinone
Temperature	308 °C