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5-methyl-3-phenyl-4-isoxazolecarboxylic acid, ester with 2-hydroxyacetophenone
SpectraBase Compound ID BwYiY2ElTcL
InChI InChI=1S/C19H15NO4/c1-13-17(18(20-24-13)15-10-6-3-7-11-15)19(22)23-12-16(21)14-8-4-2-5-9-14/h2-11H,12H2,1H3
InChIKey XHPQLCFYRGYKAK-UHFFFAOYSA-N
Mol Weight 321.33 g/mol
Molecular Formula C19H15NO4
Exact Mass 321.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnaJC6KjTqq
Name 2-Oxo-2-phenylethyl 5-methyl-3-phenyl-4-isoxazolecarboxylate
Alternate Name(s) 2-Oxo-2-phenylethyl 5-methyl-3-phenylisoxazole-4-carboxylate 5-Methyl-3-phenyl-4-isoxazolecarboxylic acid phenacyl ester 5-Methyl-3-phenyl-isoxazole-4-carboxylic acid phenacyl ester phenacyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate phenacyl 5-methyl-3-phenyl-isoxazole-4-carboxylate
CAS Registry Number 282730-82-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15NO4
InChI InChI=1S/C19H15NO4/c1-13-17(18(20-24-13)15-10-6-3-7-11-15)19(22)23-12-16(21)14-8-4-2-5-9-14/h2-11H,12H2,1H3
InChIKey XHPQLCFYRGYKAK-UHFFFAOYSA-N
Molecular Weight 321.332 g/mol
SMILES c1(c(noc1C)-c1ccccc1)C(OCC(=O)c1ccccc1)=O
SPLASH splash10-0a4i-6900000000-63d038f3be42df387978
Source of Spectrum AD-0-2532-0
Wiley ID 1433301