3-{2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-1H-pyrrol-1-yl}benzoic acid

SpectraBase Compound ID	HXuiFHz8QY5
InChI	InChI=1S/C21H14N4O2/c22-13-15(20-23-18-8-1-2-9-19(18)24-20)12-17-7-4-10-25(17)16-6-3-5-14(11-16)21(26)27/h1-12H,(H,23,24)(H,26,27)/b15-12+
InChIKey	VNBNMSFRDWKGTA-NTCAYCPXSA-N Google Search
Mol Weight	354.37 g/mol
Molecular Formula	C21H14N4O2
Exact Mass	354.111676 g/mol

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SpectraBase Spectrum ID	LCuOQQN3LHE
Name	3-{2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-1H-pyrrol-1-yl}benzoic acid
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/C21H14N4O2/c22-13-15(20-23-18-8-1-2-9-19(18)24-20)12-17-7-4-10-25(17)16-6-3-5-14(11-16)21(26)27/h1-12H,(H,23,24)(H,26,27)/b15-12+
InChIKey	VNBNMSFRDWKGTA-NTCAYCPXSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_8428
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: D36197; Labnumber: SPDEM5-38288; SBI_ID: SBI-008431
Synonyms	3-{2-[2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-1H-pyrrol-1-yl}benzoic acid
Temperature	318 °C