| SpectraBase Compound ID | 70cBkrf7wsH |
|---|---|
| InChI | InChI=1S/C15H21ClN2O2/c1-3-18-9-5-7-12(18)10-20-15(19)17-14-11(2)6-4-8-13(14)16/h4,6,8,12H,3,5,7,9-10H2,1-2H3,(H,17,19) |
| InChIKey | PZFUQVUAVRBAGG-UHFFFAOYSA-N |
| Mol Weight | 296.8 g/mol |
| Molecular Formula | C15H21ClN2O2 |
| Exact Mass | 296.129156 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6NyLLBKt5WT |
|---|---|
| Name | 2-Chloro-6-methylcarbanilic acid, (1-ethyl-2-pyrrolidinyl)methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.129155622 u |
| Formula | C15H21ClN2O2 |
| InChI | InChI=1S/C15H21ClN2O2/c1-3-18-9-5-7-12(18)10-20-15(19)17-14-11(2)6-4-8-13(14)16/h4,6,8,12H,3,5,7,9-10H2,1-2H3,(H,17,19) |
| InChIKey | PZFUQVUAVRBAGG-UHFFFAOYSA-N |
| SMILES | N(C=1C(=CC=CC1C)Cl)C(OCC1CCCN1CC)=O |