| SpectraBase Compound ID | 1TVoTQMt6ps |
|---|---|
| InChI | InChI=1S/C17H16O5/c1-3-20-17(19)22-15-9-5-8-14(11-15)21-16(18)13-7-4-6-12(2)10-13/h4-11H,3H2,1-2H3 |
| InChIKey | RQIJFKYFGSHMLZ-UHFFFAOYSA-N |
| Mol Weight | 300.31 g/mol |
| Molecular Formula | C17H16O5 |
| Exact Mass | 300.099774 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 | A0fZRf3shK3 |
|---|---|
| Name | 1,3-Benzenediol, o-ethoxycarbonyl-o'-(3-methylbenzoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.099773610 u |
| Formula | C17H16O5 |
| InChI | InChI=1S/C17H16O5/c1-3-20-17(19)22-15-9-5-8-14(11-15)21-16(18)13-7-4-6-12(2)10-13/h4-11H,3H2,1-2H3 |
| InChIKey | RQIJFKYFGSHMLZ-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC=C1OC(C1=CC=CC(=C1)C)=O)OC(=O)OCC |