SpectraBase Compound ID | G3GafPGwjaf |
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InChI | InChI=1S/C30H21N5O12S3.3Na/c31-17-1-4-22-14(7-17)11-25(49(42,43)44)27(29(22)37)34-33-19-3-6-23-16(9-19)12-26(50(45,46)47)28(30(23)38)35-32-18-2-5-21-15(8-18)10-20(13-24(21)36)48(39,40)41;;;/h1-13,36-38H,31H2,(H,39,40,41)(H,42,43,44)(H,45,46,47);;;/q;3*+1/p-3/b34-33+,35-32?;;; |
InChIKey | XQKFYYYUKJTYCO-NUEIXRBTSA-K |
Mol Weight | 805.64630785 g/mol |
Molecular Formula | C30H18N5Na3O12S3 |
Exact Mass | 804.980717 g/mol |
SpectraBase Spectrum ID | Gd0qCC62BIl |
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Name | 2-Naphthalenesulfonic acid, 7-[(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-4-hydroxy-3-[(5-hydroxy-7-sulfo-2-naphthalenyl)azo]-, trisodium salt |
CAS Registry Number | 6471-72-3 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C30H18N5Na3O12S3 |
InChI | InChI=1S/C30H21N5O12S3.3Na/c31-17-1-4-22-14(7-17)11-25(49(42,43)44)27(29(22)37)34-33-19-3-6-23-16(9-19)12-26(50(45,46)47)28(30(23)38)35-32-18-2-5-21-15(8-18)10-20(13-24(21)36)48(39,40)41;;;/h1-13,36-38H,31H2,(H,39,40,41)(H,42,43,44)(H,45,46,47);;;/q;3*+1/p-3/b34-33+,35-32?;;; |
InChIKey | XQKFYYYUKJTYCO-NUEIXRBTSA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |