SpectraBase Compound ID | HLmhPBH3uYm |
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InChI | InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-18-17-24(36(30,31)32)19-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1 |
InChIKey | SJEYSFABYSGQBG-UHFFFAOYSA-M |
Mol Weight | 566.66276928 g/mol |
Molecular Formula | C27H31N2NaO6S2 |
Exact Mass | 566.152123 g/mol |
SpectraBase Spectrum ID | LOUD4M8OFdD |
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Name | Ammonium, [4-[alpha-[p-(diethylamino)phenyl]-2,4-disulfobenzylidene]-2,5-cyclohexadien-1-ylidene]diethyl- |
CAS Registry Number | 10191-30-7 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C27H31N2NaO6S2 |
InChI | InChI=1S/C27H32N2O6S2.Na/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-18-17-24(36(30,31)32)19-26(25)37(33,34)35;/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35);/q;+1/p-1 |
InChIKey | SJEYSFABYSGQBG-UHFFFAOYSA-M |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |