SpectraBase Compound ID | 3qD3GfwJbR |
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InChI | InChI=1S/C33H25N11O7.2Na/c34-18-6-2-11-23(14-18)43-30(46)25(27(41-43)32(48)49)39-37-21-9-1-5-17(13-21)29(45)36-20-8-4-10-22(16-20)38-40-26-28(33(50)51)42-44(31(26)47)24-12-3-7-19(35)15-24;;/h1-16,46-47H,34-35H2,(H,36,45)(H,48,49)(H,50,51);;/q;2*+1/p-2/b39-37+,40-38+;; |
InChIKey | IBHVBRMEEBFSTJ-DVDDBBOFSA-L |
Mol Weight | 731.59653856 g/mol |
Molecular Formula | C33H23N11Na2O7 |
Exact Mass | 731.157731 g/mol |
SpectraBase Spectrum ID | DXsUFPGBeIs |
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Name | 3-Carboxy-1-(m-nitrophenyl)-5-pyrazolon<-3,3'-diamino-Benzanilid->3-carboxy-1-(m-nitrophenyl)-5-pyrazolon/Reduc. NO2 to NH2 |
CAS Registry Number | 6391-21-5 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C33H23N11Na2O7 |
InChI | InChI=1S/C33H25N11O7.2Na/c34-18-6-2-11-23(14-18)43-30(46)25(27(41-43)32(48)49)39-37-21-9-1-5-17(13-21)29(45)36-20-8-4-10-22(16-20)38-40-26-28(33(50)51)42-44(31(26)47)24-12-3-7-19(35)15-24;;/h1-16,46-47H,34-35H2,(H,36,45)(H,48,49)(H,50,51);;/q;2*+1/p-2/b39-37+,40-38+;; |
InChIKey | IBHVBRMEEBFSTJ-DVDDBBOFSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |