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N-(3,4-Dihydroxyphenyl)-4-oxo-4H-1-benzopyran-3-carboxamide
SpectraBase Compound ID 1aSpTUWojpF
InChI InChI=1S/C16H11NO5/c18-12-6-5-9(7-13(12)19)17-16(21)11-8-22-14-4-2-1-3-10(14)15(11)20/h1-8,18-19H,(H,17,21)
InChIKey JABMQYLMUUGRPZ-UHFFFAOYSA-N
Mol Weight 297.27 g/mol
Molecular Formula C16H11NO5
Exact Mass 297.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWpRW9M1so4
Name N-(3,4-Dihydroxyphenyl)-4-oxo-4H-1-benzopyran-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11NO5
InChI InChI=1S/C16H11NO5/c18-12-6-5-9(7-13(12)19)17-16(21)11-8-22-14-4-2-1-3-10(14)15(11)20/h1-8,18-19H,(H,17,21)
InChIKey JABMQYLMUUGRPZ-UHFFFAOYSA-N
Instrument Name VG AutoSpec
Ionization Type EI
Literature Reference DOI 10.1021/jm2004267
Molecular Weight 297.266 g/mol
SMILES N(C(C1=COc2ccccc2C1=O)=O)c1ccc(c(c1)O)O
SPLASH splash10-05fr-9630000000-47b008562f6e60110c78
Source of Spectrum AF-54-5171-17
Wiley ID 1851887