| SpectraBase Compound ID | 2q9atoCZQ1f |
|---|---|
| InChI | InChI=1S/C10H9NO/c1-2-11-7-8-5-3-4-6-9(8)10(11)12/h2-6H,1,7H2 |
| InChIKey | LPYIDHYBHVDERS-UHFFFAOYSA-N |
| Mol Weight | 159.19 g/mol |
| Molecular Formula | C10H9NO |
| Exact Mass | 159.068414 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | VLlrYCFcNE |
|---|---|
| Name | 1H-Isoindol-1-one, 2-ethenyl-2,3-dihydro-; 2-vinyl-1(3H)-isoindolinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 159.068413913 u |
| Formula | C10H9NO |
| InChI | InChI=1S/C10H9NO/c1-2-11-7-8-5-3-4-6-9(8)10(11)12/h2-6H,1,7H2 |
| InChIKey | LPYIDHYBHVDERS-UHFFFAOYSA-N |
| Molecular Weight | 159.188 g/mol |
| SMILES | C1(C=2C=CC=CC2CN1C=C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.861293 |