| SpectraBase Compound ID | IKYYESwCVFG |
|---|---|
| InChI | InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15) |
| InChIKey | URMFMMLIAIRVRO-UHFFFAOYSA-N |
| Mol Weight | 270.35 g/mol |
| Molecular Formula | C12H18N2O3S |
| Exact Mass | 270.103814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DoIEBkBVFY7 |
|---|---|
| Name | 1-Butyl-3-(2-methylphenyl)sulfonyl-urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.103813619 u |
| Formula | C12H18N2O3S |
| InChI | InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15) |
| InChIKey | URMFMMLIAIRVRO-UHFFFAOYSA-N |
| SMILES | C(NS(C=1C(C)=CC=CC1)(=O)=O)(=O)NCCCC |