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tert-Butyl 3-[3-(4-Methylphenyl)isoxazol-5-yl]-3-hydroxy-2-methylenepropanoate
SpectraBase Compound ID 8FoGb102FQt
InChI InChI=1S/C18H21NO4/c1-11-6-8-13(9-7-11)14-10-15(23-19-14)16(20)12(2)17(21)22-18(3,4)5/h6-10,16,20H,2H2,1,3-5H3
InChIKey DBRSENXDIJLCFH-UHFFFAOYSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLlp6QcELoK
Name tert-Butyl 3-[3-(4-Methylphenyl)isoxazol-5-yl]-3-hydroxy-2-methylenepropanoate
Alternate Name(s) tert-butyl 2-{hydroxy[3-(4-methylphenyl)-5-isoxazolyl]methyl}acrylate
Comments Less than 3 mono-isotopic peaks
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Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-11-6-8-13(9-7-11)14-10-15(23-19-14)16(20)12(2)17(21)22-18(3,4)5/h6-10,16,20H,2H2,1,3-5H3
InChIKey DBRSENXDIJLCFH-UHFFFAOYSA-N
Molecular Weight 315.369 g/mol
SMILES OC(c1cc(-c2ccc(cc2)C)no1)C(C(OC(C)(C)C)=O)=C
SPLASH splash10-0006-0901000000-621d362864fc1ce7efb0
Source of Spectrum SO-0-279-5
Wiley ID 864147