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2-(1-benzotriazolyl)-3-(4-chloroanilino)naphthalene-1,4-dione
SpectraBase Compound ID 7LOMFT9grRF
InChI InChI=1S/C22H13ClN4O2/c23-13-9-11-14(12-10-13)24-19-20(27-18-8-4-3-7-17(18)25-26-27)22(29)16-6-2-1-5-15(16)21(19)28/h1-12,24H
InChIKey LORBMDQOBUYYLQ-UHFFFAOYSA-N
Mol Weight 400.83 g/mol
Molecular Formula C22H13ClN4O2
Exact Mass 400.072703 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YGBn3J8HBU
Name 2-(1-benzotriazolyl)-3-(4-chloroanilino)naphthalene-1,4-dione
Alternate Name(s) 2-(benzotriazol-1-yl)-3-(4-chloroanilino)-1,4-naphthoquinone 2-(benzotriazol-1-yl)-3-(4-chloroanilino)naphthalene-1,4-dione 2-(benzotriazol-1-yl)-3-[(4-chlorophenyl)amino]naphthalene-1,4-dione
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Formula C22H13ClN4O2
InChI InChI=1S/C22H13ClN4O2/c23-13-9-11-14(12-10-13)24-19-20(27-18-8-4-3-7-17(18)25-26-27)22(29)16-6-2-1-5-15(16)21(19)28/h1-12,24H
InChIKey LORBMDQOBUYYLQ-UHFFFAOYSA-N
Molecular Weight 400.825 g/mol
SMILES N(C1=C([n]2nnc3c2cccc3)C(c2c(cccc2)C1=O)=O)c1ccc(cc1)Cl
SPLASH splash10-03fr-2933000000-6d45d8c6b2f8eddade67
Wiley ID 1463762