![phenol, 2-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]-](/api/spectrum/Ir3h13ayoH9/structure.png?h=300&w=458 "phenol, 2-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]-")
| SpectraBase Compound ID | DxiUipnVTHb |
|---|---|
| InChI | InChI=1S/C18H21N3O2/c1-23-18-13-15(7-8-17(18)22)14-19-21-11-9-20(10-12-21)16-5-3-2-4-6-16/h2-8,13-14,22H,9-12H2,1H3/b19-14+ |
| InChIKey | GHVKZBULWCGYQG-XMHGGMMESA-N |
| Mol Weight | 311.38 g/mol |
| Molecular Formula | C18H21N3O2 |
| Exact Mass | 311.163377 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ir3h13ayoH9 |
|---|---|
| Name | Phenol, 2-methoxy-4-[(E)-[(4-phenyl-1-piperazinyl)imino]methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.163376926 u |
| Formula | C18H21N3O2 |
| InChI | InChI=1S/C18H21N3O2/c1-23-18-13-15(7-8-17(18)22)14-19-21-11-9-20(10-12-21)16-5-3-2-4-6-16/h2-8,13-14,22H,9-12H2,1H3/b19-14+ |
| InChIKey | GHVKZBULWCGYQG-XMHGGMMESA-N |
| SMILES | OC1=CC=C(C=C1OC)\C=N\N1CCN(CC1)C=1C=CC=CC1 |