SpectraBase Compound ID | 5FTeWHR6a91 |
---|---|
InChI | InChI=1S/C24H18N4O7S2.2Na/c1-13(29)19(22(30)25-15-5-3-2-4-6-15)28-27-16-9-7-14(8-10-16)23-26-18-12-11-17(24(31)32)21(20(18)36-23)37(33,34)35;;/h2-12,29H,1H3,(H,25,30)(H,31,32)(H,33,34,35);;/q;2*+1/p-2/b19-13+,28-27-;; |
InChIKey | VCHPBJHFCVJHJM-ZJOFQLIWSA-L |
Mol Weight | 582.51253856 g/mol |
Molecular Formula | C24H16N4Na2O7S2 |
Exact Mass | 582.02558 g/mol |
SpectraBase Spectrum ID | Ae3oeo2gauw |
---|---|
Name | (Phenylamino)carbonyl]propyl]azo]phenyl]-7-sulfo-, disodium salt, 6-Benzothiazolecarboxylic acid, 2-[4-[[2-oxo-1-[ |
CAS Registry Number | 10214-06-9 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C24H16N4Na2O7S2 |
InChI | InChI=1S/C24H18N4O7S2.2Na/c1-13(29)19(22(30)25-15-5-3-2-4-6-15)28-27-16-9-7-14(8-10-16)23-26-18-12-11-17(24(31)32)21(20(18)36-23)37(33,34)35;;/h2-12,29H,1H3,(H,25,30)(H,31,32)(H,33,34,35);;/q;2*+1/p-2/b19-13+,28-27-;; |
InChIKey | VCHPBJHFCVJHJM-ZJOFQLIWSA-L |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |