| SpectraBase Compound ID | Ib7o3o6iHLO |
|---|---|
| InChI | InChI=1S/C20H24N2O6/c1-6-21-12(3)16(19(23)27-5)18(17(13(21)4)20(24)28-7-2)14-9-8-10-15(11-14)22(25)26/h8-11,18H,6-7H2,1-5H3 |
| InChIKey | CAFIKDSOADUKON-UHFFFAOYSA-N |
| Mol Weight | 388.42 g/mol |
| Molecular Formula | C20H24N2O6 |
| Exact Mass | 388.163436 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FfQlYrb1lMy |
|---|---|
| Name | Nitrendipine et P1395 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.163436495 u |
| Formula | C20H24N2O6 |
| InChI | InChI=1S/C20H24N2O6/c1-6-21-12(3)16(19(23)27-5)18(17(13(21)4)20(24)28-7-2)14-9-8-10-15(11-14)22(25)26/h8-11,18H,6-7H2,1-5H3 |
| InChIKey | CAFIKDSOADUKON-UHFFFAOYSA-N |
| Molecular Weight | 388.420 g/mol |
| SMILES | C1(=C(N(C(C)=C(C1C=1C=C(N(=O)=O)C=CC1)C(=O)OC)CC)C)C(=O)OCC |