SpectraBase Compound ID | Fdx34q0W4Zw |
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InChI | InChI=1S/C48H34N8O18S2.2Na/c1-73-39-17-23(11-13-33(39)49-47(61)31-15-25-7-3-5-9-29(25)41(43(31)57)53-51-35-19-27(75(67,68)69)21-37(45(35)59)55(63)64)24-12-14-34(40(18-24)74-2)50-48(62)32-16-26-8-4-6-10-30(26)42(44(32)58)54-52-36-20-28(76(70,71)72)22-38(46(36)60)56(65)66;;/h3-22,57-60H,1-2H3,(H,49,61)(H,50,62)(H,67,68,69)(H,70,71,72);;/q;2*+1/p-2/b53-51+,54-52+;; |
InChIKey | NLLARQSOIJZDFF-GEWBIHMDSA-L |
Mol Weight | 1118.92153856 g/mol |
Molecular Formula | C48H32N8Na2O18S2 |
Exact Mass | 1118.107137 g/mol |
SpectraBase Spectrum ID | 1zJkBsCcXfA |
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Name | 4,4'-Bis[[[4-[(2-hydroxy-3-nitro-4-sulfonyl)azo]-3-hydroxy-2-naphthyl]carbonyl]amino]-3,3'-dimethoxybiphenyl |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C48H32N8Na2O18S2 |
InChI | InChI=1S/C48H34N8O18S2.2Na/c1-73-39-17-23(11-13-33(39)49-47(61)31-15-25-7-3-5-9-29(25)41(43(31)57)53-51-35-19-27(75(67,68)69)21-37(45(35)59)55(63)64)24-12-14-34(40(18-24)74-2)50-48(62)32-16-26-8-4-6-10-30(26)42(44(32)58)54-52-36-20-28(76(70,71)72)22-38(46(36)60)56(65)66;;/h3-22,57-60H,1-2H3,(H,49,61)(H,50,62)(H,67,68,69)(H,70,71,72);;/q;2*+1/p-2/b53-51+,54-52+;; |
InChIKey | NLLARQSOIJZDFF-GEWBIHMDSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |