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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOHs5sL3BxO
Name 4,5-Isoxazoledicarboxylic acid, 3-phenyl-, dimethyl ester
CAS Registry Number 7710-44-3
Copyright Copyright © 2020-2024 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
Molecular Weight 261.233 g/mol
SMILES c1ccc(cc1)-c1c(c(C(=O)OC)on1)C(=O)OC
SPLASH splash10-0fb9-9230000000-26cf8f6e05f132a0a2a1
Source of Spectrum O-19-251-5
Synonyms Dimethyl 3-phenyl-4,5-isoxazoledicarboxylate 3-Phenyl-4,5-dimethoxycarbonyl-isoxazole 3-Phenylisoxazole-4,5-dicarboxylic acid dimethyl ester Dimethyl 3-phenyl-1,2-oxazole-4,5-dicarboxylate Dimethyl 3-phenylisoxazole-4,5-dicarboxylate
Wiley ID 1264632