| SpectraBase Compound ID | 1K4DI1EfnFz |
|---|---|
| InChI | InChI=1S/C20H23NO5/c1-11(22)25-16-5-4-13-6-7-21-10-14-8-18(26-12(2)23)17(24-3)9-15(14)19(16)20(13)21/h4,8-9,16,19-20H,5-7,10H2,1-3H3 |
| InChIKey | OCIKTNLQKDMICV-UHFFFAOYSA-N |
| Mol Weight | 357.41 g/mol |
| Molecular Formula | C20H23NO5 |
| Exact Mass | 357.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LpUW9Op8K8Q |
|---|---|
| Name | Norpluvine diacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.157622840 u |
| Formula | C20H23NO5 |
| InChI | InChI=1S/C20H23NO5/c1-11(22)25-16-5-4-13-6-7-21-10-14-8-18(26-12(2)23)17(24-3)9-15(14)19(16)20(13)21/h4,8-9,16,19-20H,5-7,10H2,1-3H3 |
| InChIKey | OCIKTNLQKDMICV-UHFFFAOYSA-N |
| Molecular Weight | 357.406 g/mol |
| SMILES | C1(=C(C=C2C(=C1)CN1C3C2C(CC=C3CC1)OC(C)=O)OC)OC(=O)C |