| SpectraBase Compound ID | 93ORptchReu |
|---|---|
| InChI | InChI=1S/C12H16N2S/c1-3-9-13-12(15)14-10(2)11-7-5-4-6-8-11/h3-8,10H,1,9H2,2H3,(H2,13,14,15) |
| InChIKey | ZIBGEZHZKJJINO-UHFFFAOYSA-N |
| Mol Weight | 220.33 g/mol |
| Molecular Formula | C12H16N2S |
| Exact Mass | 220.10342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Feb1WLmua8p |
|---|---|
| Name | N-Allyl-N'-(1-phenylethyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.103419697 u |
| Formula | C12H16N2S |
| InChI | InChI=1S/C12H16N2S/c1-3-9-13-12(15)14-10(2)11-7-5-4-6-8-11/h3-8,10H,1,9H2,2H3,(H2,13,14,15) |
| InChIKey | ZIBGEZHZKJJINO-UHFFFAOYSA-N |
| SMILES | N(C(=S)NCC=C)C(C=1C=CC=CC1)C |