SpectraBase Compound ID | Es8aEaa3K9e |
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InChI | InChI=1S/C40H31N3O6S2.Na/c1-25-20-30(10-19-39(25)41)40(28-4-11-33(12-5-28)42-35-15-2-26-8-17-37(50(44,45)46)23-31(26)21-35)29-6-13-34(14-7-29)43-36-16-3-27-9-18-38(51(47,48)49)24-32(27)22-36;/h2-24,42H,41H2,1H3,(H,44,45,46)(H,47,48,49);/q;+1/p-1/b40-29-,43-34+; |
InChIKey | UJMOQGMQIUKDFI-YOAYMKGJSA-M |
Mol Weight | 735.80476928 g/mol |
Molecular Formula | C40H30N3NaO6S2 |
Exact Mass | 735.147372 g/mol |
SpectraBase Spectrum ID | 3Vsjvrwkrwl |
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Name | Methylium, [4-amino-3-methylphenyl]bis[4-[(7-sulfonaphthyl-2-yl)amino]phenyl]-, monosodium salt |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C40H30N3NaO6S2 |
InChI | InChI=1S/C40H31N3O6S2.Na/c1-25-20-30(10-19-39(25)41)40(28-4-11-33(12-5-28)42-35-15-2-26-8-17-37(50(44,45)46)23-31(26)21-35)29-6-13-34(14-7-29)43-36-16-3-27-9-18-38(51(47,48)49)24-32(27)22-36;/h2-24,42H,41H2,1H3,(H,44,45,46)(H,47,48,49);/q;+1/p-1/b40-29-,43-34+; |
InChIKey | UJMOQGMQIUKDFI-YOAYMKGJSA-M |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |