SpectraBase Compound ID | C8cog4We4Pu |
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InChI | InChI=1S/C30H31N3O9S3.2Na/c1-18-8-11-23(12-9-18)43(35,36)33-26-17-24(44(37,38)39)15-22-16-27(45(40,41)42)29(30(34)28(22)26)32-31-25-13-10-21(14-19(25)2)20-6-4-3-5-7-20;;/h8-17,20,33-34H,3-7H2,1-2H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2/b32-31-;; |
InChIKey | NJHFCEDUNPPBHI-OXUGRUJKSA-L |
Mol Weight | 717.73353856 g/mol |
Molecular Formula | C30H29N3Na2O9S3 |
Exact Mass | 717.086132 g/mol |
SpectraBase Spectrum ID | EaA2WYzofKJ |
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Name | 2,7-Naphthalenedisulfonic acid, 3-[(4-cyclohexyl-2-methylphenyl)azo]-4-hydroxy-5-[[(4-methylphenyl)sulfonyl]amino]-, disodium salt |
CAS Registry Number | 10236-37-0 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C30H29N3Na2O9S3 |
InChI | InChI=1S/C30H31N3O9S3.2Na/c1-18-8-11-23(12-9-18)43(35,36)33-26-17-24(44(37,38)39)15-22-16-27(45(40,41)42)29(30(34)28(22)26)32-31-25-13-10-21(14-19(25)2)20-6-4-3-5-7-20;;/h8-17,20,33-34H,3-7H2,1-2H3,(H,37,38,39)(H,40,41,42);;/q;2*+1/p-2/b32-31-;; |
InChIKey | NJHFCEDUNPPBHI-OXUGRUJKSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |