| SpectraBase Compound ID | Kr0MJC4GOHD |
|---|---|
| InChI | InChI=1S/C7H13NO2S2/c1-3-8(4-2)7(11)12-5-6(9)10/h3-5H2,1-2H3,(H,9,10) |
| InChIKey | JLMPJCQRACBHOF-UHFFFAOYSA-N |
| Mol Weight | 207.31 g/mol |
| Molecular Formula | C7H13NO2S2 |
| Exact Mass | 207.038771 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9EHNFI5kyi0 |
|---|---|
| Name | Mercaptoacetic acid, diethyldithiocarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.038771009 u |
| Formula | C7H13NO2S2 |
| InChI | InChI=1S/C7H13NO2S2/c1-3-8(4-2)7(11)12-5-6(9)10/h3-5H2,1-2H3,(H,9,10) |
| InChIKey | JLMPJCQRACBHOF-UHFFFAOYSA-N |
| Molecular Weight | 207.306 g/mol |
| SMILES | OC(CSC(N(CC)CC)=S)=O |