| SpectraBase Compound ID | 9TxAuo0nj13 |
|---|---|
| InChI | InChI=1S/C12H14ClNO3/c1-3-17-11(15)8-14(2)12(16)9-5-4-6-10(13)7-9/h4-7H,3,8H2,1-2H3 |
| InChIKey | GYSVNHDFKREJCX-UHFFFAOYSA-N |
| Mol Weight | 255.7 g/mol |
| Molecular Formula | C12H14ClNO3 |
| Exact Mass | 255.066221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNzQZ9uVHrU |
|---|---|
| Name | Glycine, N-(3-chlorobenzoyl)-N-methyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.066221012 u |
| Formula | C12H14ClNO3 |
| InChI | InChI=1S/C12H14ClNO3/c1-3-17-11(15)8-14(2)12(16)9-5-4-6-10(13)7-9/h4-7H,3,8H2,1-2H3 |
| InChIKey | GYSVNHDFKREJCX-UHFFFAOYSA-N |
| Molecular Weight | 255.701 g/mol |
| SMILES | C1(Cl)=CC(=CC=C1)C(=O)N(CC(=O)OCC)C |