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3-[5-chloro-2-hydroxyphenyl)azo]-4,5-dihydroxy-2,7-naphthalenedisulfonic acid, disodium salt
SpectraBase Compound ID 89ICVQZpSgk
InChI InChI=1S/C16H11ClN2O9S2.2Na/c17-8-1-2-11(20)10(5-8)18-19-15-13(30(26,27)28)4-7-3-9(29(23,24)25)6-12(21)14(7)16(15)22;;/h1-6,20-22H,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/b19-18+;;
InChIKey LNXMADNIUWFTPP-BUFQOAPZSA-L
Mol Weight 518.80553856 g/mol
Molecular Formula C16H9ClN2Na2O9S2
Exact Mass 517.923338 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XZQlyDsp7y
Name 3-[5-chloro-2-hydroxyphenyl)azo]-4,5-dihydroxy-2,7-naphthalenedisulfonic acid, disodium salt
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Formula C16H9ClN2Na2O9S2
InChI InChI=1S/C16H11ClN2O9S2.2Na/c17-8-1-2-11(20)10(5-8)18-19-15-13(30(26,27)28)4-7-3-9(29(23,24)25)6-12(21)14(7)16(15)22;;/h1-6,20-22H,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/b19-18+;;
InChIKey LNXMADNIUWFTPP-BUFQOAPZSA-L
Instrument Name Varian CFT-20
Sadtler NMR Number 27531M
Solvent D2O/KOD