| SpectraBase Compound ID | F6AMcnH3sD3 |
|---|---|
| InChI | InChI=1S/C7H3Cl3O2.C2H7N/c8-3-1-2-4(9)6(10)5(3)7(11)12;1-3-2/h1-2H,(H,11,12);3H,1-2H3 |
| InChIKey | QSFRJEUITMJQCX-UHFFFAOYSA-N |
| Mol Weight | 270.54 g/mol |
| Molecular Formula | C9H10Cl3NO2 |
| Exact Mass | 268.977712 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JYEum2omGuP |
|---|---|
| Name | Trysben 200 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.977711664 u |
| Formula | C9H10Cl3NO2 |
| InChI | InChI=1S/C7H3Cl3O2.C2H7N/c8-3-1-2-4(9)6(10)5(3)7(11)12;1-3-2/h1-2H,(H,11,12);3H,1-2H3 |
| InChIKey | QSFRJEUITMJQCX-UHFFFAOYSA-N |
| SMILES | N(C)C.OC(C=1C(=CC=C(C1Cl)Cl)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.857147 |