| SpectraBase Compound ID | GSjO2v7Pn9w |
|---|---|
| InChI | InChI=1S/C14H12O3/c15-9-12-8-11(3-6-14(12)17)7-10-1-4-13(16)5-2-10/h1-6,8-9,16-17H,7H2 |
| InChIKey | OOIJRRBPTUCNMW-UHFFFAOYSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C14H12O3 |
| Exact Mass | 228.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LKGniIcnrVB |
|---|---|
| Name | Forkienin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.078644243 u |
| Formula | C14H12O3 |
| InChI | InChI=1S/C14H12O3/c15-9-12-8-11(3-6-14(12)17)7-10-1-4-13(16)5-2-10/h1-6,8-9,16-17H,7H2 |
| InChIKey | OOIJRRBPTUCNMW-UHFFFAOYSA-N |
| Molecular Weight | 228.247 g/mol |
| SMILES | C1(=C(C=CC(=C1)CC=1C=CC(=CC1)O)O)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.899473 |