| SpectraBase Compound ID | 8yws6S31SRL |
|---|---|
| InChI | InChI=1S/C10H9FO2/c1-13-9-4-2-3-6-7(9)5-8(11)10(6)12/h2-4,8H,5H2,1H3 |
| InChIKey | ZQGAJXJDRFRXAS-UHFFFAOYSA-N |
| Mol Weight | 180.18 g/mol |
| Molecular Formula | C10H9FO2 |
| Exact Mass | 180.058658 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | XXam4EO1Cw |
|---|---|
| Name | 2-Fluoranyl-4-methoxy-2,3-dihydroinden-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.058657691 u |
| Formula | C10H9FO2 |
| InChI | InChI=1S/C10H9FO2/c1-13-9-4-2-3-6-7(9)5-8(11)10(6)12/h2-4,8H,5H2,1H3 |
| InChIKey | ZQGAJXJDRFRXAS-UHFFFAOYSA-N |
| Molecular Weight | 180.178 g/mol |
| SMILES | C12=C(C(=O)C(C2)F)C=CC=C1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87505 |