| SpectraBase Compound ID | IZ6G68McHSH |
|---|---|
| InChI | InChI=1S/C10H11ClN2S/c1-2-6-12-10(14)13-9-5-3-4-8(11)7-9/h2-5,7H,1,6H2,(H2,12,13,14) |
| InChIKey | PWMJPURKWVVDJH-UHFFFAOYSA-N |
| Mol Weight | 226.72 g/mol |
| Molecular Formula | C10H11ClN2S |
| Exact Mass | 226.033147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 25ydDCac3ls |
|---|---|
| Name | N-Allyl-N'-(3-chlorophenyl)thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.033147236 u |
| Formula | C10H11ClN2S |
| InChI | InChI=1S/C10H11ClN2S/c1-2-6-12-10(14)13-9-5-3-4-8(11)7-9/h2-5,7H,1,6H2,(H2,12,13,14) |
| InChIKey | PWMJPURKWVVDJH-UHFFFAOYSA-N |
| Molecular Weight | 226.725 g/mol |
| SMILES | C(=S)(NCC=C)NC1=CC(=CC=C1)Cl |