SpectraBase Compound ID | DJ0s9Hq2IpN |
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InChI | InChI=1S/C37H30N4O10S3.2Na/c1-22-4-12-30(13-5-22)54(49,50)51-29-10-6-26(7-11-29)38-39-27-8-15-32(23(2)18-27)33-16-9-28(19-24(33)3)40-41-36-35(53(46,47)48)21-25-20-31(52(43,44)45)14-17-34(25)37(36)42;;/h4-21,42H,1-3H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b39-38+,41-40+;; |
InChIKey | YFSRRLXAGNGNNQ-WEUAPPMUSA-L |
Mol Weight | 830.80853856 g/mol |
Molecular Formula | C37H28N4Na2O10S3 |
Exact Mass | 830.076295 g/mol |
SpectraBase Spectrum ID | 9GjlkhD0Eys |
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Name | (2)Phenol/p-tosyl ester |
CAS Registry Number | 6358-57-2 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C37H28N4Na2O10S3 |
InChI | InChI=1S/C37H30N4O10S3.2Na/c1-22-4-12-30(13-5-22)54(49,50)51-29-10-6-26(7-11-29)38-39-27-8-15-32(23(2)18-27)33-16-9-28(19-24(33)3)40-41-36-35(53(46,47)48)21-25-20-31(52(43,44)45)14-17-34(25)37(36)42;;/h4-21,42H,1-3H3,(H,43,44,45)(H,46,47,48);;/q;2*+1/p-2/b39-38+,41-40+;; |
InChIKey | YFSRRLXAGNGNNQ-WEUAPPMUSA-L |
Instrument Name | Bruker IFS 85 |
Synonyms | 1-Naphthol-3,6-disulfonic acid(1)[-m-tolidine-] 2,7-Naphthalenedisulfonic acid, 3-[[2,2'-dimethyl-4'-[[4-[[ |
Technique | KBr-Pellet |