| SpectraBase Compound ID | DKKAQab5v2W |
|---|---|
| InChI | InChI=1S/C16H23NO3/c1-12(17-10-4-5-11-17)16(20-13(2)18)14-6-8-15(19-3)9-7-14/h6-9,12,16H,4-5,10-11H2,1-3H3 |
| InChIKey | NBYKUSAYQATMPD-UHFFFAOYSA-N |
| Mol Weight | 277.36 g/mol |
| Molecular Formula | C16H23NO3 |
| Exact Mass | 277.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GG1UyLgnWrG |
|---|---|
| Name | Moppp-m (dihydro-) ac P763 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.167793602 u |
| Formula | C16H23NO3 |
| InChI | InChI=1S/C16H23NO3/c1-12(17-10-4-5-11-17)16(20-13(2)18)14-6-8-15(19-3)9-7-14/h6-9,12,16H,4-5,10-11H2,1-3H3 |
| InChIKey | NBYKUSAYQATMPD-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C(C(N2CCCC2)C)OC(C)=O)C1)OC |