| SpectraBase Compound ID | Ak6B4tyPOmq |
|---|---|
| InChI | InChI=1S/C8H9NO2/c1-6-2-4-7(5-3-6)11-8(9)10/h2-5H,1H3,(H2,9,10) |
| InChIKey | CAOOVUTXOZVQON-UHFFFAOYSA-N |
| Mol Weight | 151.16 g/mol |
| Molecular Formula | C8H9NO2 |
| Exact Mass | 151.063329 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1aVpP8QAvzC |
|---|---|
| Name | Carbamic acid, p-tolyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 151.063328532 u |
| Formula | C8H9NO2 |
| InChI | InChI=1S/C8H9NO2/c1-6-2-4-7(5-3-6)11-8(9)10/h2-5H,1H3,(H2,9,10) |
| InChIKey | CAOOVUTXOZVQON-UHFFFAOYSA-N |
| SMILES | NC(OC=1C=CC(=CC1)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.974663 |