| SpectraBase Compound ID | 8d812Hf0ob3 |
|---|---|
| InChI | InChI=1S/C17H19NO3/c1-11(2)7-8-14-15(18-9-10-19)17(21)13-6-4-3-5-12(13)16(14)20/h3-7,18-19H,8-10H2,1-2H3 |
| InChIKey | BEOFXBVVJBHMGB-UHFFFAOYSA-N |
| Mol Weight | 285.34 g/mol |
| Molecular Formula | C17H19NO3 |
| Exact Mass | 285.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BgHYx3KpL6V |
|---|---|
| Name | 2-(2-Hydroxyethylamino)-3-(3-methylbut-2-enyl)-1,4-naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.136493473 u |
| Formula | C17H19NO3 |
| InChI | InChI=1S/C17H19NO3/c1-11(2)7-8-14-15(18-9-10-19)17(21)13-6-4-3-5-12(13)16(14)20/h3-7,18-19H,8-10H2,1-2H3 |
| InChIKey | BEOFXBVVJBHMGB-UHFFFAOYSA-N |
| SMILES | C1(C(=C(C(C=2C=CC=CC12)=O)CC=C(C)C)NCCO)=O |