![2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[(2-sulfophenyl)azo]-5-[(2,5,6-trichloro-4-pyrimidinyl)amino]-, trisodium salt](/api/spectrum/Q5cSmGDadw/structure.png?h=300&w=458 "2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[(2-sulfophenyl)azo]-5-[(2,5,6-trichloro-4-pyrimidinyl)amino]-, trisodium salt")
| SpectraBase Compound ID | 6ktv6C93FHU |
|---|---|
| InChI | InChI=1S/C20H12Cl3N5O10S3.3Na/c21-15-18(22)25-20(23)26-19(15)24-11-7-9(39(30,31)32)5-8-6-13(41(36,37)38)16(17(29)14(8)11)28-27-10-3-1-2-4-12(10)40(33,34)35;;;/h1-7,29H,(H,24,25,26)(H,30,31,32)(H,33,34,35)(H,36,37,38);;;/q;3*+1/p-3/b28-27+;;; |
| InChIKey | ZHDFKPUCUYZGGM-TYMWBDRGSA-K |
| Mol Weight | 750.82530785 g/mol |
| Molecular Formula | C20H9Cl3N5Na3O10S3 |
| Exact Mass | 748.827021 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Q5cSmGDadw |
|---|---|
| Name | 2,7-Naphthalenedisulfonic acid, 4-hydroxy-3-[(2-sulfophenyl)azo]-5-[(2,5,6-trichloro-4-pyrimidinyl)amino]-, trisodium salt |
| CAS Registry Number | 15792-41-3 |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C20H9Cl3N5Na3O10S3 |
| InChI | InChI=1S/C20H12Cl3N5O10S3.3Na/c21-15-18(22)25-20(23)26-19(15)24-11-7-9(39(30,31)32)5-8-6-13(41(36,37)38)16(17(29)14(8)11)28-27-10-3-1-2-4-12(10)40(33,34)35;;;/h1-7,29H,(H,24,25,26)(H,30,31,32)(H,33,34,35)(H,36,37,38);;;/q;3*+1/p-3/b28-27+;;; |
| InChIKey | ZHDFKPUCUYZGGM-TYMWBDRGSA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |