| SpectraBase Compound ID | Bft74LCjj8E |
|---|---|
| InChI | InChI=1S/C12H10N3S.ClHO4/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;2-1(3,4)5/h1-6H,13-14H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | ZXCLWPMKLDYDDF-UHFFFAOYSA-M |
| Mol Weight | 327.74 g/mol |
| Molecular Formula | C12H10ClN3O4S |
| Exact Mass | 327.008055 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 6R8WIaG052R |
|---|---|
| Name | Thionin perchlorate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 341150 |
| CAS Registry Number | 25137-58-0 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H10ClN3O4S |
| InChI | InChI=1S/C12H10N3S.ClHO4/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;2-1(3,4)5/h1-6H,13-14H2;(H,2,3,4,5)/q+1;/p-1 |
| InChIKey | ZXCLWPMKLDYDDF-UHFFFAOYSA-M |
| Observed nucleus | 13C |
| Purity | 95% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_007044 |