SpectraBase Compound ID | HXntAsD3Uv5 |
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InChI | InChI=1S/C36H32N10O6.2Na/c1-21-33(35(37)45(43-21)25-9-5-3-6-10-25)41-39-27-15-13-23(17-29(27)51-19-31(47)48)24-14-16-28(30(18-24)52-20-32(49)50)40-42-34-22(2)44-46(36(34)38)26-11-7-4-8-12-26;;/h3-18H,19-20,37-38H2,1-2H3,(H,47,48)(H,49,50);;/q;2*+1/p-2 |
InChIKey | BQPQNISYGQEILF-UHFFFAOYSA-L |
Mol Weight | 744.67953856 g/mol |
Molecular Formula | C36H30N10Na2O6 |
Exact Mass | 744.214517 g/mol |
SpectraBase Spectrum ID | 5dijTPG8vr3 |
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Name | 5-Imino-3-methyl-1-phenyl-2-pyrazolin<-(4,4'-diamino-3,3'-biphenylylendioxy)diessigacid->5-imino-3-methyl-1-phenyl-2-pyrazolin |
CAS Registry Number | 6902-25-6 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C36H30N10Na2O6 |
InChI | InChI=1S/C36H32N10O6.2Na/c1-21-33(35(37)45(43-21)25-9-5-3-6-10-25)41-39-27-15-13-23(17-29(27)51-19-31(47)48)24-14-16-28(30(18-24)52-20-32(49)50)40-42-34-22(2)44-46(36(34)38)26-11-7-4-8-12-26;;/h3-18H,19-20,37-38H2,1-2H3,(H,47,48)(H,49,50);;/q;2*+1/p-2 |
InChIKey | BQPQNISYGQEILF-UHFFFAOYSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |