| SpectraBase Compound ID | HKRa7Dh3xDD |
|---|---|
| InChI | InChI=1S/C10H13NO2/c1-8-6-4-5-7-9(8)13-10(12)11(2)3/h4-7H,1-3H3 |
| InChIKey | QKAVMOJYJHTFPY-UHFFFAOYSA-N |
| Mol Weight | 179.22 g/mol |
| Molecular Formula | C10H13NO2 |
| Exact Mass | 179.094629 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1XKOVbe062j |
|---|---|
| Name | 2-Methylphenyl-N,N-dimethylcarbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.094628661 u |
| Formula | C10H13NO2 |
| InChI | InChI=1S/C10H13NO2/c1-8-6-4-5-7-9(8)13-10(12)11(2)3/h4-7H,1-3H3 |
| InChIKey | QKAVMOJYJHTFPY-UHFFFAOYSA-N |
| Molecular Weight | 179.219 g/mol |
| SMILES | C1(OC(=O)N(C)C)=C(C)C=CC=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.930911 |