![1-Napthalenesulfonic acid, 3-[[2-chloro-4-[[4-[(2-hydroxy-7-sulfo-1-naphthyl)azo]-7-sulfo-1-napthyl]azo]-5-methoxyphenyl]azo]-4,5-dihydroxy, trisodium salt](/api/spectrum/BmnFWo2Z5R5/structure.png?h=300&w=458 "1-Napthalenesulfonic acid, 3-[[2-chloro-4-[[4-[(2-hydroxy-7-sulfo-1-naphthyl)azo]-7-sulfo-1-napthyl]azo]-5-methoxyphenyl]azo]-4,5-dihydroxy, trisodium salt")
| SpectraBase Compound ID | KdTPAwkTMRd |
|---|---|
| InChI | InChI=1S/C37H25ClN6O13S3.3Na/c1-57-33-16-28(41-43-30-17-34(60(54,55)56)22-3-2-4-31(45)35(22)37(30)47)25(38)15-29(33)42-39-27-11-10-26(21-9-8-20(14-24(21)27)59(51,52)53)40-44-36-23-13-19(58(48,49)50)7-5-18(23)6-12-32(36)46;;;/h2-17,45-47H,1H3,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;/q;3*+1/p-3/b42-39-,43-41?,44-40+;;; |
| InChIKey | LOJKZLRWCMZDSA-ADWXZTJBSA-K |
| Mol Weight | 959.21430785 g/mol |
| Molecular Formula | C37H22ClN6Na3O13S3 |
| Exact Mass | 957.978859 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | BmnFWo2Z5R5 |
|---|---|
| Name | 1-Napthalenesulfonic acid, 3-[[2-chloro-4-[[4-[(2-hydroxy-7-sulfo-1-naphthyl)azo]-7-sulfo-1-napthyl]azo]-5-methoxyphenyl]azo]-4,5-dihydroxy, trisodium salt |
| CAS Registry Number | 10130-37-7 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C37H22ClN6Na3O13S3 |
| InChI | InChI=1S/C37H25ClN6O13S3.3Na/c1-57-33-16-28(41-43-30-17-34(60(54,55)56)22-3-2-4-31(45)35(22)37(30)47)25(38)15-29(33)42-39-27-11-10-26(21-9-8-20(14-24(21)27)59(51,52)53)40-44-36-23-13-19(58(48,49)50)7-5-18(23)6-12-32(36)46;;;/h2-17,45-47H,1H3,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;/q;3*+1/p-3/b42-39-,43-41?,44-40+;;; |
| InChIKey | LOJKZLRWCMZDSA-ADWXZTJBSA-K |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |