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(E)-2-((3-amino-4-hydroxyisoquinolin-1-yl)diazenyl)-5-nitrobenzoic acid
SpectraBase Compound ID KrUvqvFZ0f9
InChI InChI=1S/C16H11N5O5/c17-14-13(22)9-3-1-2-4-10(9)15(18-14)20-19-12-6-5-8(21(25)26)7-11(12)16(23)24/h1-7,22H,(H2,17,18)(H,23,24)/b20-19+
InChIKey CKWVSTXMKIWZRU-FMQUCBEESA-N
Mol Weight 353.29 g/mol
Molecular Formula C16H11N5O5
Exact Mass 353.076018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zfjuy6e8wV
Name (E)-2-((3-amino-4-hydroxyisoquinolin-1-yl)diazenyl)-5-nitrobenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N5O5
InChI InChI=1S/C16H11N5O5/c17-14-13(22)9-3-1-2-4-10(9)15(18-14)20-19-12-6-5-8(21(25)26)7-11(12)16(23)24/h1-7,22H,(H2,17,18)(H,23,24)/b20-19+
InChIKey CKWVSTXMKIWZRU-FMQUCBEESA-N
Molecular Weight 353.294 g/mol
SMILES Nc1c(c2ccccc2c(n1)\N=N\c1ccc(cc1C(O)=O)[N+]([O-])=O)O
SPLASH splash10-0udi-2209000000-76c34b5beb77b71e6646
Source of Spectrum JX-2015-3-1138
Wiley ID 1724650