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3-Phenyl-5-(phenylethynyl)-2,1-benzisoxazole

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3-Phenyl-5-(phenylethynyl)-2,1-benzisoxazole
SpectraBase Compound ID XCDGJt7EAo
InChI InChI=1S/C21H13NO/c1-3-7-16(8-4-1)11-12-17-13-14-20-19(15-17)21(23-22-20)18-9-5-2-6-10-18/h1-10,13-15H
InChIKey HUTUQHZMEWMGAD-UHFFFAOYSA-N
Mol Weight 295.34 g/mol
Molecular Formula C21H13NO
Exact Mass 295.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JiUE254YAFq
Name 3-PHENYL-5-(PHENYLETHYNYL)ANTHRANIL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H13NO
InChI InChI=1S/C21H13NO/c1-3-7-16(8-4-1)11-12-17-13-14-20-19(15-17)21(23-22-20)18-9-5-2-6-10-18/h1-10,13-15H
InChIKey HUTUQHZMEWMGAD-UHFFFAOYSA-N
Molecular Weight 295.0994
SMILES c1cc2noc(-c3ccccc3)c2cc1C#Cc1ccccc1
SPLASH splash10-0002-5390000000-8950f660b602878023e4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany