| SpectraBase Compound ID | 4VGw7puTmwW |
|---|---|
| InChI | InChI=1S/C21H27NO4/c1-15-12-21(26-5)17(13-20(15)25-4)10-11-22(16(2)23)14-18-8-6-7-9-19(18)24-3/h6-9,12-13H,10-11,14H2,1-5H3 |
| InChIKey | RADNANMKFRVZGK-UHFFFAOYSA-N |
| Mol Weight | 357.45 g/mol |
| Molecular Formula | C21H27NO4 |
| Exact Mass | 357.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KltqPergDKu |
|---|---|
| Name | 25D-Nbome, N-(acetyl) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.194008349 u |
| Formula | C21H27NO4 |
| InChI | InChI=1S/C21H27NO4/c1-15-12-21(26-5)17(13-20(15)25-4)10-11-22(16(2)23)14-18-8-6-7-9-19(18)24-3/h6-9,12-13H,10-11,14H2,1-5H3 |
| InChIKey | RADNANMKFRVZGK-UHFFFAOYSA-N |
| Molecular Weight | 357.450 g/mol |
| SMILES | CC1=CC(=C(C=C1OC)CCN(CC1=CC=CC=C1OC)C(C)=O)OC |