| SpectraBase Compound ID | EFD317bMaPD |
|---|---|
| InChI | InChI=1S/C20H24ClNO4/c1-14(23)22(13-15-5-7-17(24-2)8-6-15)10-9-16-11-20(26-4)18(21)12-19(16)25-3/h5-8,11-12H,9-10,13H2,1-4H3 |
| InChIKey | ADUFZLCQITWPQA-UHFFFAOYSA-N |
| Mol Weight | 377.87 g/mol |
| Molecular Formula | C20H24ClNO4 |
| Exact Mass | 377.139386 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EmJ7bWAcsER |
|---|---|
| Name | 25C-Nb4Ome acetyl derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 377.139385953 u |
| Formula | C20H24ClNO4 |
| InChI | InChI=1S/C20H24ClNO4/c1-14(23)22(13-15-5-7-17(24-2)8-6-15)10-9-16-11-20(26-4)18(21)12-19(16)25-3/h5-8,11-12H,9-10,13H2,1-4H3 |
| InChIKey | ADUFZLCQITWPQA-UHFFFAOYSA-N |
| Molecular Weight | 377.868 g/mol |
| SMILES | C1=C(C(=CC(=C1Cl)OC)CCN(CC=1C=CC(=CC1)OC)C(C)=O)OC |