| SpectraBase Compound ID | 3BpfOJCW6NQ |
|---|---|
| InChI | InChI=1S/C18H12O4/c19-14-8-5-12(6-9-14)7-10-16(20)15-11-13-3-1-2-4-17(13)22-18(15)21/h1-11,19H/b10-7+ |
| InChIKey | HYVQLESTYVHESG-JXMROGBWSA-N |
| Mol Weight | 292.29 g/mol |
| Molecular Formula | C18H12O4 |
| Exact Mass | 292.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cda7uYvHHrK |
|---|---|
| Name | 3-(3-(4-Hydroxyphenyl)acryloyl)-2H-chromen-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.073558862 u |
| Formula | C18H12O4 |
| InChI | InChI=1S/C18H12O4/c19-14-8-5-12(6-9-14)7-10-16(20)15-11-13-3-1-2-4-17(13)22-18(15)21/h1-11,19H/b10-7+ |
| InChIKey | HYVQLESTYVHESG-JXMROGBWSA-N |
| SMILES | C=1(C(OC2=C(C1)C=CC=C2)=O)C(\C=C\C=1C=CC(=CC1)O)=O |