| SpectraBase Compound ID | Bmf8iwSUg3Z |
|---|---|
| InChI | InChI=1S/C17H12O5/c18-16-15(10-13-8-4-5-9-14(13)21-16)22-17(19)20-11-12-6-2-1-3-7-12/h1-10H,11H2 |
| InChIKey | YYPXUYJWPLQYGZ-UHFFFAOYSA-N |
| Mol Weight | 296.28 g/mol |
| Molecular Formula | C17H12O5 |
| Exact Mass | 296.068473 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FgFE7IhwmxT |
|---|---|
| Name | 3-(Benzyloxycarbonyloxy)-1-benzopyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.068473481 u |
| Formula | C17H12O5 |
| InChI | InChI=1S/C17H12O5/c18-16-15(10-13-8-4-5-9-14(13)21-16)22-17(19)20-11-12-6-2-1-3-7-12/h1-10H,11H2 |
| InChIKey | YYPXUYJWPLQYGZ-UHFFFAOYSA-N |
| SMILES | C=1(C(OC=2C(C1)=CC=CC2)=O)OC(=O)OCC=1C=CC=CC1 |