| SpectraBase Compound ID | FILoWsFt5Yx |
|---|---|
| InChI | InChI=1S/C13H20N2OS/c1-3-15(4-2)10-11-16-13(17)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,17) |
| InChIKey | KLPQLZXQFXHFOH-UHFFFAOYSA-N |
| Mol Weight | 252.38 g/mol |
| Molecular Formula | C13H20N2OS |
| Exact Mass | 252.129634 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | kfvZynxmRx |
|---|---|
| Name | o-(2-Diethylaminoethyl) N-phenylcarbamothioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.129634445 u |
| Formula | C13H20N2OS |
| InChI | InChI=1S/C13H20N2OS/c1-3-15(4-2)10-11-16-13(17)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,17) |
| InChIKey | KLPQLZXQFXHFOH-UHFFFAOYSA-N |
| Molecular Weight | 252.376 g/mol |
| SMILES | C(NC=1C=CC=CC1)(=S)OCCN(CC)CC |