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4-Isoxazolepropanoic acid, 5-methyl-.beta.-methylene-3-phenyl-, methyl ester
SpectraBase Compound ID Ju1Rm2IsEDD
InChI InChI=1S/C15H15NO3/c1-10(9-13(17)18-3)14-11(2)19-16-15(14)12-7-5-4-6-8-12/h4-8H,1,9H2,2-3H3
InChIKey AZRDLXPEULKDND-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C15H15NO3
Exact Mass 257.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4X2P0RQ98Y
Name 4-Isoxazolepropanoic acid, 5-methyl-.beta.-methylene-3-phenyl-, methyl ester
Alternate Name(s) 4-(1'-Methoxycarbonylmethylvinyl)-5-methyl-3-phenyl-isoxazole Methyl 3-(5-methyl-3-phenyl-4-isoxazolyl)-3-butenoate
CAS Registry Number 61728-35-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO3
InChI InChI=1S/C15H15NO3/c1-10(9-13(17)18-3)14-11(2)19-16-15(14)12-7-5-4-6-8-12/h4-8H,1,9H2,2-3H3
InChIKey AZRDLXPEULKDND-UHFFFAOYSA-N
Molecular Weight 257.289 g/mol
SMILES c1(c(noc1C)-c1ccccc1)C(CC(=O)OC)=C
SPLASH splash10-0006-9820000000-1e3ae196895825af7def
Source of Spectrum H-59-2092-33
Wiley ID 1260846