| SpectraBase Compound ID | AHZ2X59d7Ve |
|---|---|
| InChI | InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1 |
| InChIKey | FAKRSMQSSFJEIM-RQJHMYQMSA-N |
| Mol Weight | 217.28 g/mol |
| Molecular Formula | C9H15NO3S |
| Exact Mass | 217.077265 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 1fDrEe6yVU |
|---|---|
| Name | Captopril |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 441600 |
| CAS Registry Number | 62571-86-2 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15NO3S |
| InChI | InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1 |
| InChIKey | FAKRSMQSSFJEIM-RQJHMYQMSA-N |
| Observed nucleus | 13C |
| Purity | 97% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | N-[(S)-3-Mercapto-2-methylpropionyl]-L-proline Capoten |
| Wiley ID | SIAL_13CNMR_009709 |