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5-METHYLTHIO-3-(6-PHENYL-1,3,5-HEXATRIENYL)-ISOXAZOLE

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5-METHYLTHIO-3-(6-PHENYL-1,3,5-HEXATRIENYL)-ISOXAZOLE
SpectraBase Compound ID 45Sb2xKPYK4
InChI InChI=1S/C16H15NOS/c1-19-16-13-15(17-18-16)12-8-3-2-5-9-14-10-6-4-7-11-14/h2-13H,1H3/b3-2+,9-5+,12-8+
InChIKey TZYSNEHIVPXCCC-PMHXHJSWSA-N
Mol Weight 269.36 g/mol
Molecular Formula C16H15NOS
Exact Mass 269.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YH64IRaYXv
Name 5-(methylthio)-3-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NOS
InChI InChI=1S/C16H15NOS/c1-19-16-13-15(17-18-16)12-8-3-2-5-9-14-10-6-4-7-11-14/h2-13H,1H3/b3-2+,9-5+,12-8+
InChIKey TZYSNEHIVPXCCC-PMHXHJSWSA-N
Molecular Weight 269.362 g/mol
SMILES c1c(onc1\C=C\C=C\C=C\c1ccccc1)SC
SPLASH splash10-00dl-0390000000-07fdb1d2cc0780f8c4bb
Source of Spectrum Y-28-1345-2
Synonyms 5-Methylsulfanyl-3-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1,2-oxazole 5-Methylsulfanyl-3-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]isoxazole
Wiley ID 1273267