SpectraBase Compound ID | 5WNYZKY80hm |
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InChI | InChI=1S/C32H22N4O18S4.2Cu.4Na/c37-21-7-13(1-3-19(21)33-35-29-25(57(49,50)51)9-15-5-17(55(43,44)45)11-23(39)27(15)31(29)41)14-2-4-20(22(38)8-14)34-36-30-26(58(52,53)54)10-16-6-18(56(46,47)48)12-24(40)28(16)32(30)42;;;;;;/h1-12,37-42H,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;;;/q;2*+2;4*+1/p-8/b35-33+,36-34+;;;;;; |
InChIKey | XVYJREIPXSNSQK-YVPKWBBTSA-F |
Mol Weight | 1089.76567713 g/mol |
Molecular Formula | C32H14Cu2N4Na4O18S4 |
Exact Mass | 1087.736865 g/mol |
SpectraBase Spectrum ID | 2HCzhRPskzR |
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Name | Chromotropacid[-o-dianisidine-]chromotropic acid/OCH3 to OH U. Cu complex |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C32H14Cu2N4Na4O18S4 |
InChI | InChI=1S/C32H22N4O18S4.2Cu.4Na/c37-21-7-13(1-3-19(21)33-35-29-25(57(49,50)51)9-15-5-17(55(43,44)45)11-23(39)27(15)31(29)41)14-2-4-20(22(38)8-14)34-36-30-26(58(52,53)54)10-16-6-18(56(46,47)48)12-24(40)28(16)32(30)42;;;;;;/h1-12,37-42H,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;;;/q;2*+2;4*+1/p-8/b35-33+,36-34+;;;;;; |
InChIKey | XVYJREIPXSNSQK-YVPKWBBTSA-F |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |