| SpectraBase Compound ID | 69p7CFxrwzw |
|---|---|
| InChI | InChI=1S/C12H17N3O2/c1-17-11-4-2-3-10(9-11)14-5-7-15(8-6-14)12(13)16/h2-4,9H,5-8H2,1H3,(H2,13,16) |
| InChIKey | QBEAXMVRUUJBFD-UHFFFAOYSA-N |
| Mol Weight | 235.29 g/mol |
| Molecular Formula | C12H17N3O2 |
| Exact Mass | 235.132077 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | QdhV8jpRHs |
|---|---|
| Name | Piperazine-1-carboxamide, 4-(3-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.132076797 u |
| Formula | C12H17N3O2 |
| InChI | InChI=1S/C12H17N3O2/c1-17-11-4-2-3-10(9-11)14-5-7-15(8-6-14)12(13)16/h2-4,9H,5-8H2,1H3,(H2,13,16) |
| InChIKey | QBEAXMVRUUJBFD-UHFFFAOYSA-N |
| Molecular Weight | 235.287 g/mol |
| SMILES | C1=C(C=C(C=C1)N1CCN(C(N)=O)CC1)OC |