SpectraBase Compound ID | 6vatH6x6nKF |
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InChI | InChI=1S/C31H35N3O6S2.Na/c1-5-33(6-2)23-13-9-21(10-14-23)30(22-11-15-24(16-12-22)34(7-3)8-4)27-20-29(42(38,39)40)31(32)28-19-25(41(35,36)37)17-18-26(27)28;/h9-20,32H,5-8H2,1-4H3,(H2,35,36,37,38,39,40);/q;+1/p-1 |
InChIKey | MUKNQCIAQMYLMP-UHFFFAOYSA-M |
Mol Weight | 631.73776928 g/mol |
Molecular Formula | C31H34N3NaO6S2 |
Exact Mass | 631.178672 g/mol |
SpectraBase Spectrum ID | FlEwrDqAkLb |
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Name | Sodium 1-amino-4-{[4-(diethylamino)phenyl][4-(diethyliminio)-2,5-cyclohexadien-1-ylidene]methyl}-2,7-naphthalenedisulfonate |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C31H34N3NaO6S2 |
InChI | InChI=1S/C31H35N3O6S2.Na/c1-5-33(6-2)23-13-9-21(10-14-23)30(22-11-15-24(16-12-22)34(7-3)8-4)27-20-29(42(38,39)40)31(32)28-19-25(41(35,36)37)17-18-26(27)28;/h9-20,32H,5-8H2,1-4H3,(H2,35,36,37,38,39,40);/q;+1/p-1 |
InChIKey | MUKNQCIAQMYLMP-UHFFFAOYSA-M |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |