| SpectraBase Compound ID | BAnKdeJm42R |
|---|---|
| InChI | InChI=1S/C20H19N3O8S2.2Na/c1-10-6-11(2)18(16(7-10)32(26,27)28)22-23-19-17(33(29,30)31)8-13-4-5-14(21-12(3)24)9-15(13)20(19)25;;/h4-9,25H,1-3H3,(H,21,24)(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2 |
| InChIKey | BBGISJHSJIMGKU-UHFFFAOYSA-L |
| Mol Weight | 537.46853856 g/mol |
| Molecular Formula | C20H17N3Na2O8S2 |
| Exact Mass | 537.025245 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 2bby3K2kDDe |
|---|---|
| Name | 2-Amino-3,5-xylolsulfonic acid->N-acetyl-gamma-acid |
| CAS Registry Number | 6369-41-1 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H17N3Na2O8S2 |
| InChI | InChI=1S/C20H19N3O8S2.2Na/c1-10-6-11(2)18(16(7-10)32(26,27)28)22-23-19-17(33(29,30)31)8-13-4-5-14(21-12(3)24)9-15(13)20(19)25;;/h4-9,25H,1-3H3,(H,21,24)(H,26,27,28)(H,29,30,31);;/q;2*+1/p-2 |
| InChIKey | BBGISJHSJIMGKU-UHFFFAOYSA-L |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |