| SpectraBase Compound ID | 73CmJgAS5Fz |
|---|---|
| InChI | InChI=1S/C16H20N2O3/c1-4-16(20)18(11(2)19)8-7-12-10-17-15-6-5-13(21-3)9-14(12)15/h5-6,9-10,17H,4,7-8H2,1-3H3 |
| InChIKey | GOFQGRRSKSNNKZ-UHFFFAOYSA-N |
| Mol Weight | 288.35 g/mol |
| Molecular Formula | C16H20N2O3 |
| Exact Mass | 288.147393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5RF81IJ1xuC |
|---|---|
| Name | Melatonin prop |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.147392509 u |
| Formula | C16H20N2O3 |
| InChI | InChI=1S/C16H20N2O3/c1-4-16(20)18(11(2)19)8-7-12-10-17-15-6-5-13(21-3)9-14(12)15/h5-6,9-10,17H,4,7-8H2,1-3H3 |
| InChIKey | GOFQGRRSKSNNKZ-UHFFFAOYSA-N |
| Molecular Weight | 288.347 g/mol |
| SMILES | C=12C(NC=C2CCN(C(CC)=O)C(=O)C)=CC=C(C1)OC |