SpectraBase Compound ID | 4b2kumJDy3o |
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InChI | InChI=1S/C34H27N5O8S2.2Na/c1-18-13-21(4-10-28(18)36-38-32-27-17-24(35)7-3-20(27)6-12-30(32)40)22-5-11-29(19(2)14-22)37-39-33-31(49(45,46)47)16-23-15-25(48(42,43)44)8-9-26(23)34(33)41;;/h3-17,40-41H,35H2,1-2H3,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-36?,39-37+;; |
InChIKey | ZNBQFUAPZORWIW-LEYWHJHYSA-L |
Mol Weight | 741.70053856 g/mol |
Molecular Formula | C34H25N5Na2O8S2 |
Exact Mass | 741.093994 g/mol |
SpectraBase Spectrum ID | jjYUC8P8OR |
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Name | 2,7-Naphthalenedisulfonic acid, 3-[[4'-[(7-amino-2-hydroxy-1-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-4-hydroxy-, disodium salt |
CAS Registry Number | 6420-12-8 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C34H25N5Na2O8S2 |
InChI | InChI=1S/C34H27N5O8S2.2Na/c1-18-13-21(4-10-28(18)36-38-32-27-17-24(35)7-3-20(27)6-12-30(32)40)22-5-11-29(19(2)14-22)37-39-33-31(49(45,46)47)16-23-15-25(48(42,43)44)8-9-26(23)34(33)41;;/h3-17,40-41H,35H2,1-2H3,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-36?,39-37+;; |
InChIKey | ZNBQFUAPZORWIW-LEYWHJHYSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |