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Benzoic acid, 2-[2-(4-hydroxy-3-methyl-1-isoquinolinyl)diazenyl]-5-nitro-
SpectraBase Compound ID 3eSPVTiP4mc
InChI InChI=1S/C17H12N4O5/c1-9-15(22)11-4-2-3-5-12(11)16(18-9)20-19-14-7-6-10(21(25)26)8-13(14)17(23)24/h2-8,22H,1H3,(H,23,24)/b20-19+
InChIKey OWCFDIXTDFRDKC-FMQUCBEESA-N
Mol Weight 352.31 g/mol
Molecular Formula C17H12N4O5
Exact Mass 352.080769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JRRIF3a3nf
Name Benzoic acid, 2-[2-(4-hydroxy-3-methyl-1-isoquinolinyl)diazenyl]-5-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N4O5
InChI InChI=1S/C17H12N4O5/c1-9-15(22)11-4-2-3-5-12(11)16(18-9)20-19-14-7-6-10(21(25)26)8-13(14)17(23)24/h2-8,22H,1H3,(H,23,24)/b20-19+
InChIKey OWCFDIXTDFRDKC-FMQUCBEESA-N
Molecular Weight 352.306 g/mol
SMILES OC(c1cc(ccc1\N=N\c1nc(c(c2ccccc12)O)C)[N+]([O-])=O)=O
SPLASH splash10-0udi-1419000000-d51e0c01cd9b97cd8cf7
Source of Spectrum JX-2015-3-1105
Synonyms (E)-2-((4-hydroxy-3-methylisoquinolin-1-yl)diazenyl)-5-nitrobenzoic acid
Wiley ID 1724617