| SpectraBase Compound ID | 8RKsjzZtMlp |
|---|---|
| InChI | InChI=1S/C15H22N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h1,7,11-13,15H,2-6,8-10H2 |
| InChIKey | QMGGMESMCJCABO-UHFFFAOYSA-N |
| Mol Weight | 262.35 g/mol |
| Molecular Formula | C15H22N2O2 |
| Exact Mass | 262.168128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Nvo9qG2ocu |
|---|---|
| Name | Sophocarpine, N-oxide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.168127954 u |
| Formula | C15H22N2O2 |
| InChI | InChI=1S/C15H22N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h1,7,11-13,15H,2-6,8-10H2 |
| InChIKey | QMGGMESMCJCABO-UHFFFAOYSA-N |
| Molecular Weight | 262.353 g/mol |
| SMILES | C1CCN2(C3C1CN1C(C3CCC2)CC=CC1=O)=O |