![2-{[2-(Tert-butylthio)ethyl]thio}ethanethiol, methylthiocarbamate](/api/spectrum/8y76yv4FDc3/structure.png?h=300&w=458 "2-{[2-(Tert-butylthio)ethyl]thio}ethanethiol, methylthiocarbamate")
| SpectraBase Compound ID | IMpOyXzG1yE |
|---|---|
| InChI | InChI=1S/C10H21NOS3/c1-10(2,3)15-8-6-13-5-7-14-9(12)11-4/h5-8H2,1-4H3,(H,11,12) |
| InChIKey | WGFQAOOSTCNAMW-UHFFFAOYSA-N |
| Mol Weight | 267.46 g/mol |
| Molecular Formula | C10H21NOS3 |
| Exact Mass | 267.078528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8y76yv4FDc3 |
|---|---|
| Name | 2-{[2-(Tert-butylthio)ethyl]thio}ethanethiol, methylthiocarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.078527821 u |
| Formula | C10H21NOS3 |
| InChI | InChI=1S/C10H21NOS3/c1-10(2,3)15-8-6-13-5-7-14-9(12)11-4/h5-8H2,1-4H3,(H,11,12) |
| InChIKey | WGFQAOOSTCNAMW-UHFFFAOYSA-N |
| Molecular Weight | 267.464 g/mol |
| SMILES | N(C(SCCSCCSC(C)(C)C)=O)C |