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2-(p-Tolylethynyl)benzoxazole
SpectraBase Compound ID SsskZijfRL
InChI InChI=1S/C16H11NO/c1-12-6-8-13(9-7-12)10-11-16-17-14-4-2-3-5-15(14)18-16/h2-9H,1H3
InChIKey GPJNJEMCKMHIGC-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C16H11NO
Exact Mass 233.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kc8ixVPuRDi
Name 2-(p-Tolylethynyl)benzoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11NO
InChI InChI=1S/C16H11NO/c1-12-6-8-13(9-7-12)10-11-16-17-14-4-2-3-5-15(14)18-16/h2-9H,1H3
InChIKey GPJNJEMCKMHIGC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300514d
Molecular Weight 233.270 g/mol
SMILES c1cc2nc(C#Cc3ccc(cc3)C)oc2cc1
SPLASH splash10-001i-2290000000-83f60269d04a1f3f5f18
Source of Spectrum A1-14-1824/SMS5-3b
Synonyms 2-(p-tolylethynyl)benzo[d]oxazole
Wiley ID 1750169