| 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
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| SpectraBase Spectrum ID | DsNW1py3S9x |
|---|---|
| Name | 4-Methylaniline-3-sulfonic acid->3-Hydroxy-2-naphthoic acid-Ca salt |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| 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 |