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3-phenyl-4,5-isoxazoledicarboxylic acid, dimethyl ester
SpectraBase Compound ID HmAqmGQ8R90
InChI InChI=1S/C13H11NO5/c1-17-12(15)9-10(8-6-4-3-5-7-8)14-19-11(9)13(16)18-2/h3-7H,1-2H3
InChIKey BMFIBMLGDMNPHC-UHFFFAOYSA-N
Mol Weight 261.23 g/mol
Molecular Formula C13H11NO5
Exact Mass 261.063722 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Hl0qyE7L6rv
Name 3-PHENYL-4,5-ISOXAZOLEDICARBOXYLIC ACID, DIMETHYL ESTER
Source of Sample E. Kaji, Kitasato University, Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO5
InChI InChI=1S/C13H11NO5/c1-17-12(15)9-10(8-6-4-3-5-7-8)14-19-11(9)13(16)18-2/h3-7H,1-2H3
InChIKey BMFIBMLGDMNPHC-UHFFFAOYSA-N
Literature Reference CHEM. PHARM. BULL. TOKYO 26, 3254(1978) Abstract-Chemical Abstracts= 90, 87332(1979)
Melting Point 63.5-64.5C
Molecular Weight 261.233002
Synonyms 4,5-ISOXAZOLEDICARBOXYLIC ACID, 3-PHENYL-, DIMETHYL ESTER
Technique CAPILLARY CELL: MELT (CRYSTALLINE PHASE)