SpectraBase Compound ID | 9WSkNOSnxkP |
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InChI | InChI=1S/C32H23N7O13S3.3Na/c33-30-24(14-27(54(47,48)49)22-12-20(53(44,45)46)13-26(42)29(22)30)38-36-18-5-7-21-15(9-18)10-28(55(50,51)52)31(32(21)43)39-35-17-3-1-16(2-4-17)34-37-23-8-6-19(40)11-25(23)41;;;/h1-14,40-43H,33H2,(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3/b37-34?,38-36?,39-35-;;; |
InChIKey | SJAYLHDLMUMMAW-JVZFZNEJSA-K |
Mol Weight | 875.69730785 g/mol |
Molecular Formula | C32H20N7Na3O13S3 |
Exact Mass | 874.99743 g/mol |
SpectraBase Spectrum ID | 4j5n0STWROL |
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Name | 1,7-Naphthalenedisulfonic acid, 4-amino-3-[[6-[[4-[(2,4-dihydroxyphenyl)azo]phenyl]azo]-5-hydroxy-7-sulfo-2-naphthalenyl]azo]-5-hydroxy-, trisodium salt |
CAS Registry Number | 13221-05-1 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C32H20N7Na3O13S3 |
InChI | InChI=1S/C32H23N7O13S3.3Na/c33-30-24(14-27(54(47,48)49)22-12-20(53(44,45)46)13-26(42)29(22)30)38-36-18-5-7-21-15(9-18)10-28(55(50,51)52)31(32(21)43)39-35-17-3-1-16(2-4-17)34-37-23-8-6-19(40)11-25(23)41;;;/h1-14,40-43H,33H2,(H,44,45,46)(H,47,48,49)(H,50,51,52);;;/q;3*+1/p-3/b37-34?,38-36?,39-35-;;; |
InChIKey | SJAYLHDLMUMMAW-JVZFZNEJSA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |