| SpectraBase Compound ID | NJUQQ8GAvQ |
|---|---|
| InChI | InChI=1S/C9H13NO4S3/c1-15-6-4-7(9(11)12)10-17(13,14)8-3-2-5-16-8/h2-3,5,7,10H,4,6H2,1H3,(H,11,12) |
| InChIKey | STIVWJFLTMFQAK-UHFFFAOYSA-N |
| Mol Weight | 295.39 g/mol |
| Molecular Formula | C9H13NO4S3 |
| Exact Mass | 295.000671 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3PSukwbpHHI |
|---|---|
| Name | methyl-N-(2-thienylsulfonyl)homocysteine |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.000671421 u |
| Formula | C9H13NO4S3 |
| InChI | InChI=1S/C9H13NO4S3/c1-15-6-4-7(9(11)12)10-17(13,14)8-3-2-5-16-8/h2-3,5,7,10H,4,6H2,1H3,(H,11,12) |
| InChIKey | STIVWJFLTMFQAK-UHFFFAOYSA-N |
| Molecular Weight | 295.386 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_1202 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12269316 |