Butanedioic acid, mono[1-(2-carboxyethyl)-3-phenyl-1-(phenylethynyl)-2-propynyl]ester

SpectraBase Compound ID	35lawdLFgHe
InChI	InChI=1S/C24H20O6/c25-21(26)11-12-23(29)30-24(18-15-22(27)28,16-13-19-7-3-1-4-8-19)17-14-20-9-5-2-6-10-20/h1-10H,11-12,15,18H2,(H,25,26)(H,27,28)
InChIKey	ZANIZXUVRDYRND-UHFFFAOYSA-N Google Search
Mol Weight	404.42 g/mol
Molecular Formula	C24H20O6
Exact Mass	404.125988 g/mol

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SpectraBase Spectrum ID	A0sH9zhtbqQ
Name	Butanedioic acid, mono[1-(2-carboxyethyl)-3-phenyl-1-(phenylethynyl)-2-propynyl]ester
CAS Registry Number	129602-77-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H20O6
InChI	InChI=1S/C24H20O6/c25-21(26)11-12-23(29)30-24(18-15-22(27)28,16-13-19-7-3-1-4-8-19)17-14-20-9-5-2-6-10-20/h1-10H,11-12,15,18H2,(H,25,26)(H,27,28)
InChIKey	ZANIZXUVRDYRND-UHFFFAOYSA-N
Molecular Weight	404.418 g/mol
SMILES	OC(CCC(OC(CCC(=O)O)(C#Cc1ccccc1)C#Cc1ccccc1)=O)=O
SPLASH	splash10-0zic-0190000000-e15d51881654462f3470
Source of Spectrum	KC-1990-1508-7
Synonyms	4-[(3-carboxypropanoyl)oxy]-6-phenyl-4-(phenylethynyl)-5-hexynoic acid 6-Phenyl-4-phenylethynyl-4-(3'-carboxypropanoyloxy)hex-5-ynoic acid
Wiley ID	1371395