SpectraBase Compound ID | 3xa9QM2S7CQ |
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InChI | InChI=1S/C28H21N5O14S4.4Na/c1-14(34)29-23-10-11-24(50(42,43)44)20-13-25(51(45,46)47)27(28(35)26(20)23)33-32-22-9-8-21(18-7-6-17(12-19(18)22)49(39,40)41)31-30-15-2-4-16(5-3-15)48(36,37)38;;;;/h2-13,35H,1H3,(H,29,34)(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,45,46,47);;;;/q;4*+1/p-4/b31-30-,33-32+;;;; |
InChIKey | GMMAPXRGRVJYJY-OXYXOBGMSA-J |
Mol Weight | 867.66407713 g/mol |
Molecular Formula | C28H17N5Na4O14S4 |
Exact Mass | 866.924562 g/mol |
SpectraBase Spectrum ID | 3nr7dPPmt9y |
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Name | 1,7-Naphthalenedisulfonic acid, 4-(acetylamino)-5-hydroxy-6-[[7-sulfo-4-[(4-sulfophenyl)azo]-1-naphthalenyl]azo]-, tetrasodium salt |
CAS Registry Number | 2519-30-4 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C28H17N5Na4O14S4 |
InChI | InChI=1S/C28H21N5O14S4.4Na/c1-14(34)29-23-10-11-24(50(42,43)44)20-13-25(51(45,46)47)27(28(35)26(20)23)33-32-22-9-8-21(18-7-6-17(12-19(18)22)49(39,40)41)31-30-15-2-4-16(5-3-15)48(36,37)38;;;;/h2-13,35H,1H3,(H,29,34)(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,45,46,47);;;;/q;4*+1/p-4/b31-30-,33-32+;;;; |
InChIKey | GMMAPXRGRVJYJY-OXYXOBGMSA-J |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |