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KKOXXKHZBQIPJF-UHFFFAOYSA-N
SpectraBase Compound ID 7VMGrAClvt3
InChI InChI=1S/C16H13NO2/c1-18-14-9-7-13(8-10-14)16-11-15(17-19-16)12-5-3-2-4-6-12/h2-11H,1H3
InChIKey KKOXXKHZBQIPJF-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C16H13NO2
Exact Mass 251.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12a4LzFZ65O
Name Isoxazole, 5-(4-methoxyphenyl)-3-phenyl-
Alternate Name(s) 5-(4-Methoxyphenyl)-3-phenyl-isoxazole 5-(4-Methoxyphenyl)-3-phenylisoxazole 5-(4-Methoxyphenyl)-3-phenyl-1,2-oxazole
CAS Registry Number 3672-51-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO2
InChI InChI=1S/C16H13NO2/c1-18-14-9-7-13(8-10-14)16-11-15(17-19-16)12-5-3-2-4-6-12/h2-11H,1H3
InChIKey KKOXXKHZBQIPJF-UHFFFAOYSA-N
Molecular Weight 251.285 g/mol
SMILES COc1ccc(-c2cc(-c3ccccc3)no2)cc1
SPLASH splash10-0udr-2920000000-98d76b3bc0017f2e2dd8
Source of Spectrum O-3-1520-5
Wiley ID 1254670