SpectraBase Compound ID | BlDjvMSpBxQ |
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InChI | InChI=1S/C45H32N10O13S2.2Na/c56-31-9-13-35(37(58)21-31)52-48-27-3-1-5-29(19-27)50-54-41-39(69(63,64)65)17-23-15-25(7-11-33(23)43(41)60)46-45(62)47-26-8-12-34-24(16-26)18-40(70(66,67)68)42(44(34)61)55-51-30-6-2-4-28(20-30)49-53-36-14-10-32(57)22-38(36)59;;/h1-22,56-61H,(H2,46,47,62)(H,63,64,65)(H,66,67,68);;/q;2*+1/p-2/b52-48-,53-49-,54-50+,55-51+;; |
InChIKey | DBXLDWIVIRKUFJ-DWIWEVBESA-L |
Mol Weight | 1028.89153856 g/mol |
Molecular Formula | C45H30N10Na2O13S2 |
Exact Mass | 1028.123062 g/mol |
SpectraBase Spectrum ID | 5a5hyYZRyKf |
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Name | 2-Naphthalenesulfonic acid, 7,7'-(carbonyldiimino)bis[3-[[3-[(2,4-dihydroxyphenyl)azo]phenyl]azo]-4-hydroxy-, disodium salt |
CAS Registry Number | 6428-34-8 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C45H30N10Na2O13S2 |
InChI | InChI=1S/C45H32N10O13S2.2Na/c56-31-9-13-35(37(58)21-31)52-48-27-3-1-5-29(19-27)50-54-41-39(69(63,64)65)17-23-15-25(7-11-33(23)43(41)60)46-45(62)47-26-8-12-34-24(16-26)18-40(70(66,67)68)42(44(34)61)55-51-30-6-2-4-28(20-30)49-53-36-14-10-32(57)22-38(36)59;;/h1-22,56-61H,(H2,46,47,62)(H,63,64,65)(H,66,67,68);;/q;2*+1/p-2/b52-48-,53-49-,54-50+,55-51+;; |
InChIKey | DBXLDWIVIRKUFJ-DWIWEVBESA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |