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3-(3-Benzotriazol-1-yl-1,4-dioxo-1,4-dihydro-naphthalen-2-ylamino)-benzoic acid
SpectraBase Compound ID IaCTJC6CtLG
InChI InChI=1S/C23H14N4O4/c28-21-15-8-1-2-9-16(15)22(29)20(27-18-11-4-3-10-17(18)25-26-27)19(21)24-14-7-5-6-13(12-14)23(30)31/h1-12,24H,(H,30,31)
InChIKey SEXWJBVPCJURDW-UHFFFAOYSA-N
Mol Weight 410.39 g/mol
Molecular Formula C23H14N4O4
Exact Mass 410.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FH3i59kHJVf
Name 3-(3-Benzotriazol-1-yl-1,4-dioxo-1,4-dihydro-naphthalen-2-ylamino)-benzoic acid
Alternate Name(s) 3-[[3-(1-benzotriazolyl)-1,4-dioxo-2-naphthalenyl]amino]benzoic acid 3-[[3-(benzotriazol-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]benzoic acid 3-[[3-(benzotriazol-1-yl)-1,4-diketo-2-naphthyl]amino]benzoic acid 3-[[3-(benzotriazol-1-yl)-1,4-dioxo-2-naphthyl]amino]benzoic acid 3-[[3-(benzotriazol-1-yl)-1,4-dioxonaphthalen-2-yl]amino]benzoic acid
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Formula C23H14N4O4
InChI InChI=1S/C23H14N4O4/c28-21-15-8-1-2-9-16(15)22(29)20(27-18-11-4-3-10-17(18)25-26-27)19(21)24-14-7-5-6-13(12-14)23(30)31/h1-12,24H,(H,30,31)
InChIKey SEXWJBVPCJURDW-UHFFFAOYSA-N
Molecular Weight 410.389 g/mol
SMILES N(C1=C([n]2nnc3c2cccc3)C(c2c(cccc2)C1=O)=O)c1cc(C(=O)O)ccc1
SPLASH splash10-000i-6797000000-98f07f004a3196af8a3c
Wiley ID 1442384