SpectraBase Compound ID | CCL6BDiYzvN |
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InChI | InChI=1S/C29H36N2O6S2.Na/c1-7-30(8-2)24-15-11-22(12-16-24)28(23-13-17-25(18-14-23)31(9-3)10-4)26-19-27(38(32,33)34)21(6)29(20(26)5)39(35,36)37;/h11-19H,7-10H2,1-6H3,(H-,32,33,34,35,36,37);/q;+1/p-1 |
InChIKey | DEYQRLCTONFJHV-UHFFFAOYSA-M |
Mol Weight | 594.71676928 g/mol |
Molecular Formula | C29H35N2NaO6S2 |
Exact Mass | 594.183423 g/mol |
SpectraBase Spectrum ID | 6xOqgo1h1x0 |
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Name | Methylium, bis[[4-(diethyl)amino]phenyl][2,4-dimethyl-3,5-disulfophenyl]-, monosodium salt |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C29H35N2NaO6S2 |
InChI | InChI=1S/C29H36N2O6S2.Na/c1-7-30(8-2)24-15-11-22(12-16-24)28(23-13-17-25(18-14-23)31(9-3)10-4)26-19-27(38(32,33)34)21(6)29(20(26)5)39(35,36)37;/h11-19H,7-10H2,1-6H3,(H-,32,33,34,35,36,37);/q;+1/p-1 |
InChIKey | DEYQRLCTONFJHV-UHFFFAOYSA-M |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |