SpectraBase Compound ID | 9V3SlCSuuTh |
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InChI | InChI=1S/C30H23N5O6S.Na/c31-21-8-4-6-18(14-21)29(37)32-23-11-5-7-19(15-23)30(38)33-24-12-13-25-20(16-24)17-26(42(39,40)41)27(28(25)36)35-34-22-9-2-1-3-10-22;/h1-17,36H,31H2,(H,32,37)(H,33,38)(H,39,40,41);/q;+1/p-1 |
InChIKey | VHCZDHWXLDGZHC-UHFFFAOYSA-M |
Mol Weight | 603.58476928 g/mol |
Molecular Formula | C30H22N5NaO6S |
Exact Mass | 603.118849 g/mol |
SpectraBase Spectrum ID | 5DhK7WuBQoJ |
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Name | 2-Naphthalenesulfonic acid, 7-[[3-[(3-aminobenzoyl)amino]Benzoyl]amino]-4-hydroxy-3-(phenylazo)-, monosodium salt |
CAS Registry Number | 6417-29-4 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C30H22N5NaO6S |
InChI | InChI=1S/C30H23N5O6S.Na/c31-21-8-4-6-18(14-21)29(37)32-23-11-5-7-19(15-23)30(38)33-24-12-13-25-20(16-24)17-26(42(39,40)41)27(28(25)36)35-34-22-9-2-1-3-10-22;/h1-17,36H,31H2,(H,32,37)(H,33,38)(H,39,40,41);/q;+1/p-1 |
InChIKey | VHCZDHWXLDGZHC-UHFFFAOYSA-M |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |