| SpectraBase Compound ID | If9TEHoTmlw |
|---|---|
| InChI | InChI=1S/C11H15FN2S/c1-8(2)7-13-11(15)14-10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H2,13,14,15) |
| InChIKey | KZEXFJANMGCARM-UHFFFAOYSA-N |
| Mol Weight | 226.31 g/mol |
| Molecular Formula | C11H15FN2S |
| Exact Mass | 226.093998 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9CuVcIDRfzt |
|---|---|
| Name | N-(4-Fluorophenyl)-N'-isobutylthiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.093997828 u |
| Formula | C11H15FN2S |
| InChI | InChI=1S/C11H15FN2S/c1-8(2)7-13-11(15)14-10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H2,13,14,15) |
| InChIKey | KZEXFJANMGCARM-UHFFFAOYSA-N |
| Molecular Weight | 226.313 g/mol |
| SMILES | N(C(=S)NCC(C)C)C=1C=CC(=CC1)F |