| SpectraBase Compound ID | HPLlxb4TWA0 |
|---|---|
| InChI | InChI=1S/C18H21NO2/c1-13(2)21-16-10-7-9-15(12-16)19(4)18(20)17-11-6-5-8-14(17)3/h5-13H,1-4H3 |
| InChIKey | VMPFWVNJCIBUIX-UHFFFAOYSA-N |
| Mol Weight | 283.37 g/mol |
| Molecular Formula | C18H21NO2 |
| Exact Mass | 283.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9CiJrnMgqJ7 |
|---|---|
| Name | Mepronil, N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.157228918 u |
| Formula | C18H21NO2 |
| InChI | InChI=1S/C18H21NO2/c1-13(2)21-16-10-7-9-15(12-16)19(4)18(20)17-11-6-5-8-14(17)3/h5-13H,1-4H3 |
| InChIKey | VMPFWVNJCIBUIX-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC=C1)C)C(N(C1=CC(OC(C)C)=CC=C1)C)=O |