| SpectraBase Compound ID | 5NgpsUeiieU |
|---|---|
| InChI | InChI=1S/C12H17NOS/c1-4-13(5-2)12(15)14-11-8-6-10(3)7-9-11/h6-9H,4-5H2,1-3H3 |
| InChIKey | GHRVTJNJCFBPNG-UHFFFAOYSA-N |
| Mol Weight | 223.33 g/mol |
| Molecular Formula | C12H17NOS |
| Exact Mass | 223.103085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNnvlYt5j3U |
|---|---|
| Name | o-[4'-(Methylphenyl) N,N-diethylthiocarbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.103085344 u |
| Formula | C12H17NOS |
| InChI | InChI=1S/C12H17NOS/c1-4-13(5-2)12(15)14-11-8-6-10(3)7-9-11/h6-9H,4-5H2,1-3H3 |
| InChIKey | GHRVTJNJCFBPNG-UHFFFAOYSA-N |
| Molecular Weight | 223.334 g/mol |
| SMILES | C(OC1=CC=C(C=C1)C)(=S)N(CC)CC |