![2-Naphthalenesulfonic acid, 7-[[4-chloro-6-(p-sulfoanilino)-s-triazin-2-yl]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-](/api/spectrum/22b8AY8Ycgj/structure.png?h=300&w=458 "2-Naphthalenesulfonic acid, 7-[[4-chloro-6-(p-sulfoanilino)-s-triazin-2-yl]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-")
| SpectraBase Compound ID | KdwC2BbwCTB |
|---|---|
| InChI | InChI=1S/C27H22ClN7O11S3.3Na/c1-35(27-31-25(28)30-26(32-27)29-15-3-7-18(8-4-15)47(37,38)39)16-5-9-19-14(11-16)12-22(49(43,44)45)23(24(19)36)34-33-20-10-6-17(46-2)13-21(20)48(40,41)42;;;/h3-13,36H,1-2H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,29,30,31,32);;;/q;3*+1/p-3/b34-33+;;; |
| InChIKey | YFIWOVRNIAJHTA-RCWDREBLSA-K |
| Mol Weight | 818.08930785 g/mol |
| Molecular Formula | C27H19ClN7Na3O11S3 |
| Exact Mass | 816.968629 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 22b8AY8Ycgj |
|---|---|
| Name | 2-Naphthalenesulfonic acid, 7-[[4-chloro-6-(p-sulfoanilino)-s-triazin-2-yl]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]- |
| CAS Registry Number | 14408-24-3 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C27H19ClN7Na3O11S3 |
| InChI | InChI=1S/C27H22ClN7O11S3.3Na/c1-35(27-31-25(28)30-26(32-27)29-15-3-7-18(8-4-15)47(37,38)39)16-5-9-19-14(11-16)12-22(49(43,44)45)23(24(19)36)34-33-20-10-6-17(46-2)13-21(20)48(40,41)42;;;/h3-13,36H,1-2H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,29,30,31,32);;;/q;3*+1/p-3/b34-33+;;; |
| InChIKey | YFIWOVRNIAJHTA-RCWDREBLSA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |