| SpectraBase Compound ID | Hjk8RXNbBox |
|---|---|
| InChI | InChI=1S/C32H23ClN8O14S4.4Na/c33-30-37-31(34-18-6-9-20(10-7-18)56(44,45)46)39-32(38-30)35-19-8-11-24(58(50,51)52)22(14-19)40-41-27-25(59(53,54)55)13-17-12-21(57(47,48)49)15-23(26(17)28(27)42)36-29(43)16-4-2-1-3-5-16;;;;/h1-15,42H,(H,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H2,34,35,37,38,39);;;;/q;4*+1/p-4/b41-40+;;;; |
| InChIKey | NUZJNUDPZLPKAR-CARHPIHDSA-J |
| Mol Weight | 995.19807713 g/mol |
| Molecular Formula | C32H19ClN8Na4O14S4 |
| Exact Mass | 993.918287 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 7XMwpG64jfb |
|---|---|
| Name | 2,7-Naphthalenedisulfonic acid, 5-(benzoylamino)-3-[[5-[[4-chloro-6-[(4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]azo]-4-hydroxy-, tetrasodium salt |
| CAS Registry Number | 17681-50-4 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C32H19ClN8Na4O14S4 |
| InChI | InChI=1S/C32H23ClN8O14S4.4Na/c33-30-37-31(34-18-6-9-20(10-7-18)56(44,45)46)39-32(38-30)35-19-8-11-24(58(50,51)52)22(14-19)40-41-27-25(59(53,54)55)13-17-12-21(57(47,48)49)15-23(26(17)28(27)42)36-29(43)16-4-2-1-3-5-16;;;;/h1-15,42H,(H,36,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H2,34,35,37,38,39);;;;/q;4*+1/p-4/b41-40+;;;; |
| InChIKey | NUZJNUDPZLPKAR-CARHPIHDSA-J |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |