| SpectraBase Compound ID | 5ldMKpTHeh8 |
|---|---|
| InChI | InChI=1S/C12H11NO3/c14-6-5-13-10-7-11(15)8-3-1-2-4-9(8)12(10)16/h1-4,7,13-14H,5-6H2 |
| InChIKey | HDOTXWTUYIFUQH-UHFFFAOYSA-N |
| Mol Weight | 217.22 g/mol |
| Molecular Formula | C12H11NO3 |
| Exact Mass | 217.073893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | gnCB0YAsQS |
|---|---|
| Name | 2-(2-Hydroxyethylamino)-1,4-naphthoquinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.073893215 u |
| Formula | C12H11NO3 |
| InChI | InChI=1S/C12H11NO3/c14-6-5-13-10-7-11(15)8-3-1-2-4-9(8)12(10)16/h1-4,7,13-14H,5-6H2 |
| InChIKey | HDOTXWTUYIFUQH-UHFFFAOYSA-N |
| Molecular Weight | 217.224 g/mol |
| SMILES | C12=C(C(C(=CC2=O)NCCO)=O)C=CC=C1 |