| SpectraBase Compound ID | 6AlxBoy0abs |
|---|---|
| InChI | InChI=1S/C12H16ClNO3/c1-3-16-7-8-17-12(15)14-11-9(2)5-4-6-10(11)13/h4-6H,3,7-8H2,1-2H3,(H,14,15) |
| InChIKey | RVXDTKJPLBUIKK-UHFFFAOYSA-N |
| Mol Weight | 257.72 g/mol |
| Molecular Formula | C12H16ClNO3 |
| Exact Mass | 257.081871 g/mol |
Raman Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7f4bBDW3WeE |
|---|---|
| Name | 2-Chloro-6-methylcarbanilic acid, 2-ethoxyethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.081871076 u |
| Formula | C12H16ClNO3 |
| InChI | InChI=1S/C12H16ClNO3/c1-3-16-7-8-17-12(15)14-11-9(2)5-4-6-10(11)13/h4-6H,3,7-8H2,1-2H3,(H,14,15) |
| InChIKey | RVXDTKJPLBUIKK-UHFFFAOYSA-N |
| SMILES | N(C1=C(C=CC=C1C)Cl)C(OCCOCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.860102 |