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Isoxazole-3-carboxylic acid, 5-(3,4-dimethoxyphenyl)-, methyl ester
SpectraBase Compound ID 7bDIh1EKEcq
InChI InChI=1S/C13H13NO5/c1-16-10-5-4-8(6-12(10)17-2)11-7-9(14-19-11)13(15)18-3/h4-7H,1-3H3
InChIKey WHIZBBOEHIOEDP-UHFFFAOYSA-N
Mol Weight 263.25 g/mol
Molecular Formula C13H13NO5
Exact Mass 263.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RL7etzwbad
Name Isoxazole-3-carboxylic acid, 5-(3,4-dimethoxyphenyl)-, methyl ester
Alternate Name(s) 5-(3,4-dimethoxyphenyl)-3-isoxazolecarboxylic acid methyl ester 5-(3,4-dimethoxyphenyl)isoxazole-3-carboxylic acid methyl ester Methyl 5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxylate Methyl 5-(3,4-dimethoxyphenyl)isoxazole-3-carboxylate
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Formula C13H13NO5
InChI InChI=1S/C13H13NO5/c1-16-10-5-4-8(6-12(10)17-2)11-7-9(14-19-11)13(15)18-3/h4-7H,1-3H3
InChIKey WHIZBBOEHIOEDP-UHFFFAOYSA-N
Molecular Weight 263.249 g/mol
SMILES COc1ccc(-c2cc(C(OC)=O)no2)cc1OC
SPLASH splash10-06vi-9620000000-9efd6de9a92b6c45e9af
Wiley ID 1447587