SpectraBase Compound ID | 3Q70iz8Y8w9 |
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InChI | InChI=1S/C21H14N2O6S.Ca/c24-19-16(21(25)26)11-13-6-2-3-7-14(13)18(19)23-22-17-10-9-12-5-1-4-8-15(12)20(17)30(27,28)29;/h1-11,24H,(H,25,26)(H,27,28,29);/q;+2/p-2 |
InChIKey | OVHKKOQGPOYPLY-UHFFFAOYSA-L |
Mol Weight | 460.47 g/mol |
Molecular Formula | C21H12CaN2O6S |
Exact Mass | 460.004198 g/mol |
SpectraBase Spectrum ID | 96ecrjySsK9 |
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Name | 2-Naphthalenecarboxylic acid, 3-hydroxy-4-[(1-sulfo-2-naphthalenyl)azo]-, calcium salt |
CAS Registry Number | 6417-83-0 |
Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C21H12CaN2O6S |
InChI | InChI=1S/C21H14N2O6S.Ca/c24-19-16(21(25)26)11-13-6-2-3-7-14(13)18(19)23-22-17-10-9-12-5-1-4-8-15(12)20(17)30(27,28)29;/h1-11,24H,(H,25,26)(H,27,28,29);/q;+2/p-2 |
InChIKey | OVHKKOQGPOYPLY-UHFFFAOYSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |