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1,2-Dihydro-1-oxo-2-(4-tolyl)-3-hydroxy-4-(2-nitrophenylazo)isoquinoline
SpectraBase Compound ID DiNvMklVTUM
InChI InChI=1S/C22H16N4O4/c1-14-10-12-15(13-11-14)25-21(27)17-7-3-2-6-16(17)20(22(25)28)24-23-18-8-4-5-9-19(18)26(29)30/h2-13,28H,1H3/b24-23+
InChIKey FCJQDTNNZNCQTE-WCWDXBQESA-N
Mol Weight 400.39 g/mol
Molecular Formula C22H16N4O4
Exact Mass 400.117155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdyRYFiXCwg
Name 1,2-Dihydro-1-oxo-2-(4-tolyl)-3-hydroxy-4-(2-nitrophenylazo)isoquinoline
Alternate Name(s) 3-Hydroxy-2-(4-methylphenyl)-4-[(E)-(2-nitrophenyl)diazenyl]-1(2H)-isoquinolinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16N4O4
InChI InChI=1S/C22H16N4O4/c1-14-10-12-15(13-11-14)25-21(27)17-7-3-2-6-16(17)20(22(25)28)24-23-18-8-4-5-9-19(18)26(29)30/h2-13,28H,1H3/b24-23+
InChIKey FCJQDTNNZNCQTE-WCWDXBQESA-N
Molecular Weight 400.394 g/mol
SMILES OC=1N(C(c2c(cccc2)C1\N=N\c1c(N(=O)=O)cccc1)=O)c1ccc(cc1)C
SPLASH splash10-0udi-1330900000-58af93e3f29ab4b4dd6c
Source of Spectrum IC-1108-0-0
Wiley ID 1369380