2-(Benzo[1,3]dioxol-5-ylethynyl)aniline

SpectraBase Compound ID	6Re2Ugihczm
InChI	InChI=1S/C15H11NO2/c16-13-4-2-1-3-12(13)7-5-11-6-8-14-15(9-11)18-10-17-14/h1-4,6,8-9H,10,16H2
InChIKey	QNDCTMFJDVEDHH-UHFFFAOYSA-N Google Search
Mol Weight	237.26 g/mol
Molecular Formula	C15H11NO2
Exact Mass	237.078979 g/mol

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SpectraBase Spectrum ID	BmOx1xiEyyq
Name	2-(Benzo[1,3]dioxol-5-ylethynyl)aniline
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H11NO2
InChI	InChI=1S/C15H11NO2/c16-13-4-2-1-3-12(13)7-5-11-6-8-14-15(9-11)18-10-17-14/h1-4,6,8-9H,10,16H2
InChIKey	QNDCTMFJDVEDHH-UHFFFAOYSA-N
Literature Reference DOI	10.1021/ol9014877
Molecular Weight	237.258 g/mol
SMILES	Nc1c(cccc1)C#Cc1cc2c(cc1)OCO2
SPLASH	splash10-000i-0690000000-acf0fa708b0110e4e1d7
Source of Spectrum	A1-11-4262/SMS6-21h
Synonyms	2-(benzo[d][1,3]dioxol-5-ylethynyl)aniline
Wiley ID	1757165