![1-[(2,4-Dichlorophenoxy)acetyl]-4-methylpiperazine](/api/spectrum/2VgrxHz3igi/structure.png?h=300&w=458 "1-[(2,4-Dichlorophenoxy)acetyl]-4-methylpiperazine")
| SpectraBase Compound ID | 5A6icoCxJVg |
|---|---|
| InChI | InChI=1S/C13H16Cl2N2O2/c1-16-4-6-17(7-5-16)13(18)9-19-12-3-2-10(14)8-11(12)15/h2-3,8H,4-7,9H2,1H3 |
| InChIKey | MNWGMSUHJKKATQ-UHFFFAOYSA-N |
| Mol Weight | 303.19 g/mol |
| Molecular Formula | C13H16Cl2N2O2 |
| Exact Mass | 302.058883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2VgrxHz3igi |
|---|---|
| Name | 1-[(2,4-Dichlorophenoxy)acetyl]-4-methylpiperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.058883161 u |
| Formula | C13H16Cl2N2O2 |
| InChI | InChI=1S/C13H16Cl2N2O2/c1-16-4-6-17(7-5-16)13(18)9-19-12-3-2-10(14)8-11(12)15/h2-3,8H,4-7,9H2,1H3 |
| InChIKey | MNWGMSUHJKKATQ-UHFFFAOYSA-N |
| SMILES | CN1CCN(C(COC2=C(C=C(C=C2)Cl)Cl)=O)CC1 |