| SpectraBase Compound ID | 4dBkGwRUocT |
|---|---|
| InChI | InChI=1S/C22H29NO4/c1-6-17-13-22(27-5)18(14-21(17)26-4)11-12-23(16(2)24)15-19-9-7-8-10-20(19)25-3/h7-10,13-14H,6,11-12,15H2,1-5H3 |
| InChIKey | IAWUTBSTLJHYDV-UHFFFAOYSA-N |
| Mol Weight | 371.48 g/mol |
| Molecular Formula | C22H29NO4 |
| Exact Mass | 371.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ep1q9oQR9yE |
|---|---|
| Name | 25E-Nbome ac P1320 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 371.209658414 u |
| Formula | C22H29NO4 |
| InChI | InChI=1S/C22H29NO4/c1-6-17-13-22(27-5)18(14-21(17)26-4)11-12-23(16(2)24)15-19-9-7-8-10-20(19)25-3/h7-10,13-14H,6,11-12,15H2,1-5H3 |
| InChIKey | IAWUTBSTLJHYDV-UHFFFAOYSA-N |
| Molecular Weight | 371.477 g/mol |
| SMILES | C=1(C=C(C(=CC1OC)CC)OC)CCN(CC=1C(=CC=CC1)OC)C(=O)C |