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N-(3,4-dimethylisoxazol-5-yl)-4-(3-formyl-4-hydroxy-phenyl)azo-benzenesulfonamide
SpectraBase Compound ID Kp1mJACW1aB
InChI InChI=1S/C18H16N4O5S/c1-11-12(2)21-27-18(11)22-28(25,26)16-6-3-14(4-7-16)19-20-15-5-8-17(24)13(9-15)10-23/h3-10,22,24H,1-2H3
InChIKey YYOPNBRDUYFWSC-UHFFFAOYSA-N
Mol Weight 400.41 g/mol
Molecular Formula C18H16N4O5S
Exact Mass 400.084141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kfm7BJy4qAZ
Name N-(3,4-dimethylisoxazol-5-yl)-4-(3-formyl-4-hydroxy-phenyl)azo-benzenesulfonamide
Appearance Golden
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Formula C18H16N4O5S
InChI InChI=1S/C18H16N4O5S/c1-11-12(2)21-27-18(11)22-28(25,26)16-6-3-14(4-7-16)19-20-15-5-8-17(24)13(9-15)10-23/h3-10,22,24H,1-2H3
InChIKey YYOPNBRDUYFWSC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8222 EX
Ionization Type EI
Literature Reference DOI 10.1002/aoc.6813
Molecular Weight 400.409 g/mol
SMILES Oc1ccc(N=Nc2ccc(S(Nc3c(C)c(C)no3)(=O)=O)cc2)cc1C=O
SPLASH splash10-0035-9233000000-06e7edf59c3360d7dfae
Source of Spectrum AOC-36-6-MIBS
Wiley ID 1877510