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5-Butyryl-3-phenyl-4,5-dihydroisoxazole-5-carboxylic acid ethyl ester
SpectraBase Compound ID 8EwNRBdaSol
InChI InChI=1S/C16H19NO4/c1-3-8-14(18)16(15(19)20-4-2)11-13(17-21-16)12-9-6-5-7-10-12/h5-7,9-10H,3-4,8,11H2,1-2H3
InChIKey CZEVFSCALVKQSM-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iqTwW6CmUo
Name 5-Butyryl-3-phenyl-4,5-dihydroisoxazole-5-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 5-butyryl-3-phenyl-4,5-dihydroisoxazole-5-carboxylate
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Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-3-8-14(18)16(15(19)20-4-2)11-13(17-21-16)12-9-6-5-7-10-12/h5-7,9-10H,3-4,8,11H2,1-2H3
InChIKey CZEVFSCALVKQSM-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc02084g
Molecular Weight 289.331 g/mol
SMILES C1(CC(=NO1)c1ccccc1)(C(=O)CCC)C(=O)OCC
SPLASH splash10-00di-9110000000-3fa04a9a5806479a0029
Source of Spectrum KD-50-6906/SM-3am
Wiley ID 1754669