SpectraBase Compound ID | KmWsOBlkdJn |
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InChI | InChI=1S/C44H30N6O8S3.2Na/c51-59(52)41-33(21-25-37(43(41)60(53,54)55)47-49-39-31-17-9-7-11-27(31)19-23-35(39)45-29-13-3-1-4-14-29)34-22-26-38(44(42(34)59)61(56,57)58)48-50-40-32-18-10-8-12-28(32)20-24-36(40)46-30-15-5-2-6-16-30;;/h1-26,45-46H,(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2/b49-47+,50-48+;; |
InChIKey | SIPJZESIKYVJAC-GOMIHYJDSA-L |
Mol Weight | 910.90153856 g/mol |
Molecular Formula | C44H28N6Na2O8S3 |
Exact Mass | 910.092614 g/mol |
SpectraBase Spectrum ID | J7eOwJJHDHO |
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Name | 4,6-Dibenzothiophenedisulfonic acid, 3,7-bis[[2-(phenylamino)-1-naphthalenyl]azo]-5,5-dioxide-, disodium salt |
CAS Registry Number | 6391-35-1 |
Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula | C44H28N6Na2O8S3 |
InChI | InChI=1S/C44H30N6O8S3.2Na/c51-59(52)41-33(21-25-37(43(41)60(53,54)55)47-49-39-31-17-9-7-11-27(31)19-23-35(39)45-29-13-3-1-4-14-29)34-22-26-38(44(42(34)59)61(56,57)58)48-50-40-32-18-10-8-12-28(32)20-24-36(40)46-30-15-5-2-6-16-30;;/h1-26,45-46H,(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2/b49-47+,50-48+;; |
InChIKey | SIPJZESIKYVJAC-GOMIHYJDSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |