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2-{(4-Chlorophenyl)ethynyl}benzoxazole
SpectraBase Compound ID 1Edaa8hGWFd
InChI InChI=1S/C15H8ClNO/c16-12-8-5-11(6-9-12)7-10-15-17-13-3-1-2-4-14(13)18-15/h1-6,8-9H
InChIKey SLJVVCIHTMVKCL-UHFFFAOYSA-N
Mol Weight 253.69 g/mol
Molecular Formula C15H8ClNO
Exact Mass 253.029442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQgkYgRmMfe
Name 2-{(4-Chlorophenyl)ethynyl}benzoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8ClNO
InChI InChI=1S/C15H8ClNO/c16-12-8-5-11(6-9-12)7-10-15-17-13-3-1-2-4-14(13)18-15/h1-6,8-9H
InChIKey SLJVVCIHTMVKCL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300514d
Molecular Weight 253.688 g/mol
SMILES c1cc2nc(C#Cc3ccc(cc3)Cl)oc2cc1
SPLASH splash10-0udi-1190000000-7ea3f7869d9041fab724
Source of Spectrum A1-14-1824/SMS7-3e
Synonyms 2-((4-Chlorophenyl)ethynyl)benzo[d]oxazole
Wiley ID 1750172