N-(3-Oxo-1,3-dihydro-2-benzofuran-5-yl)-5-isoxazolecarboxamide

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Systematic / IUPAC Name: N-(3-Oxo-1,3-dihydro-2-benzofuran-5-yl)-1,2-oxazole-5-carboxamide

ID: Reference4580

Other Names: 5-Isoxazolecarboxamide, N-(1,3-dihydro-3-oxo-5-isobenzofuranyl)-

Formula: C12H8N2O4

Spectral Data

N-(3-Oxo-1,3-dihydro-2-benzofuran-5-yl)-5-isoxazolecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 160
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/18/2016 7:55:18 AM
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Identificators

InChI InChI=1S/C12H8N2O4/c15-11(10-3-4-13-18-10)14-8-2-1-7-6-17-12(16)9(7)5-8/h1-5H,6H2,(H,14,15)
InChI Key NANYFSLJLBFCSI-UHFFFAOYSA-N
Canonical SMILES C1C2=C(C=C(C=C2)NC(=O)C3=CC=NO3)C(=O)O1
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Other Names 5-Isoxazolecarboxamide, N-(1,3-dihydro-3-oxo-5-isobenzofuranyl)-

In Other Databases

PubChem 2810952
ChemSpider 2089367