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2-[(9,10-Dioxo-9,10-dihydro-1-anthracenyl)amino]benzoic acid, tms derivative

View entire compound with spectra: 1 NMR

2-[(9,10-Dioxo-9,10-dihydro-1-anthracenyl)amino]benzoic acid, tms derivative
SpectraBase Compound ID 89chwyUnoAN
InChI InChI=1S/C24H21NO4Si/c1-30(2,3)29-24(28)17-11-6-7-13-19(17)25-20-14-8-12-18-21(20)23(27)16-10-5-4-9-15(16)22(18)26/h4-14,25H,1-3H3
InChIKey AZMRMVPAUXHCEV-UHFFFAOYSA-N
Mol Weight 415.52 g/mol
Molecular Formula C24H21NO4Si
Exact Mass 415.123985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KyIsVP7xPVl
Name 2-[(9,10-Dioxo-9,10-dihydro-1-anthracenyl)amino]benzoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 415.123984691 u
Formula C24H21NO4Si
InChI InChI=1S/C24H21NO4Si/c1-30(2,3)29-24(28)17-11-6-7-13-19(17)25-20-14-8-12-18-21(20)23(27)16-10-5-4-9-15(16)22(18)26/h4-14,25H,1-3H3
InChIKey AZMRMVPAUXHCEV-UHFFFAOYSA-N
Molecular Weight 415.520 g/mol
SMILES C1(NC2=C3C(=CC=C2)C(=O)C2=C(C3=O)C=CC=C2)=C(C=CC=C1)C(O[Si](C)(C)C)=O