![N-(3-chlorophenyl)-N'-[2-(4-fluorophenyl)ethyl]thiourea](/api/spectrum/LLYyMTrrGZz/structure.png?h=300&w=458 "N-(3-chlorophenyl)-N'-[2-(4-fluorophenyl)ethyl]thiourea")
| SpectraBase Compound ID | IT0SCEMfiBY |
|---|---|
| InChI | InChI=1S/C15H14ClFN2S/c16-12-2-1-3-14(10-12)19-15(20)18-9-8-11-4-6-13(17)7-5-11/h1-7,10H,8-9H2,(H2,18,19,20) |
| InChIKey | QLQMJMJLDPACCH-UHFFFAOYSA-N |
| Mol Weight | 308.8 g/mol |
| Molecular Formula | C15H14ClFN2S |
| Exact Mass | 308.055025 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LLYyMTrrGZz |
|---|---|
| Name | N-(3-Chlorophenyl)-N'-[2-(4-fluorophenyl)ethyl]thiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.055025496 u |
| Formula | C15H14ClFN2S |
| InChI | InChI=1S/C15H14ClFN2S/c16-12-2-1-3-14(10-12)19-15(20)18-9-8-11-4-6-13(17)7-5-11/h1-7,10H,8-9H2,(H2,18,19,20) |
| InChIKey | QLQMJMJLDPACCH-UHFFFAOYSA-N |
| Molecular Weight | 308.802 g/mol |
| SMILES | N(CCC1=CC=C(C=C1)F)C(NC=1C=CC=C(C1)Cl)=S |