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4-Methylaniline-3-sulfonic acid->3-Hydroxy-2-naphthoic acid-Ca salt
SpectraBase Compound ID Iiof50V0N1g
InChI InChI=1S/C18H14N2O6S.Ca/c1-10-6-7-12(9-15(10)27(24,25)26)19-20-17-13-5-3-2-4-11(13)8-14(21)16(17)18(22)23;/h2-9,21H,1H3,(H,22,23)(H,24,25,26);/q;+2/p-2/b20-19+;
InChIKey COTCEAQKOQUZHB-RZLHGTIFSA-L
Mol Weight 424.44 g/mol
Molecular Formula C18H12CaN2O6S
Exact Mass 424.004198 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ZlRgr4L4XB
Name 4-Methylaniline-3-sulfonic acid->3-Hydroxy-2-naphthoic acid-Ca salt
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Formula C18H12CaN2O6S
InChI InChI=1S/C18H14N2O6S.Ca/c1-10-6-7-12(9-15(10)27(24,25)26)19-20-17-13-5-3-2-4-11(13)8-14(21)16(17)18(22)23;/h2-9,21H,1H3,(H,22,23)(H,24,25,26);/q;+2/p-2/b20-19+;
InChIKey COTCEAQKOQUZHB-RZLHGTIFSA-L
Instrument Name Bruker IFS 85
Technique KBr-Pellet