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Tert-Butyle 5-nitro-1-benzofuran-2-carboxylate
SpectraBase Compound ID EYUB6Qg9we9
InChI InChI=1S/C13H13NO5/c1-13(2,3)19-12(15)11-7-8-6-9(14(16)17)4-5-10(8)18-11/h4-7H,1-3H3
InChIKey JOAPRIPBRKUTHQ-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 DhNCGU2rXxH
Name Tert-Butyle 5-nitro-1-benzofuran-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO5
InChI InChI=1S/C13H13NO5/c1-13(2,3)19-12(15)11-7-8-6-9(14(16)17)4-5-10(8)18-11/h4-7H,1-3H3
InChIKey JOAPRIPBRKUTHQ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol401610e
Molecular Weight 263.249 g/mol
SMILES c1(cc2cc(C(=O)OC(C)(C)C)oc2cc1)[N+](=O)[O-]
SPLASH splash10-0a4i-9570000000-b5c4e31cb30475c17271
Source of Spectrum A1-15-3876/SMS14-14d
Synonyms tert-Butyl 5-nitrobenzofuran-2-carboxylate 5-Nitro-2-benzofurancarboxylic acid tert-butyl ester tert-Butyl 5-nitro-1-benzofuran-2-carboxylate
Wiley ID 1748931