| SpectraBase Compound ID | 1igb3GbuASY |
|---|---|
| InChI | InChI=1S/C10H10O7S.Na/c1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15;/h3-5H,1-2H3,(H,13,14,15);/q;+1/p-1 |
| InChIKey | LLHSEQCZSNZLRI-UHFFFAOYSA-M |
| Mol Weight | 296.22476928 g/mol |
| Molecular Formula | C10H9NaO7S |
| Exact Mass | 295.996668 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | JuKtpTSlvGZ |
|---|---|
| Name | Dimethyl 5-sulfoisophthalate sodium salt |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 150010 |
| CAS Registry Number | 3965-55-7 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H9NaO7S |
| InChI | InChI=1S/C10H10O7S.Na/c1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15;/h3-5H,1-2H3,(H,13,14,15);/q;+1/p-1 |
| InChIKey | LLHSEQCZSNZLRI-UHFFFAOYSA-M |
| Observed nucleus | 13C |
| Purity | 98% |
| Solvent | D2O |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_001490 |