| SpectraBase Compound ID | 2xfrgptTEDK |
|---|---|
| InChI | InChI=1S/C11H16N2O3S/c1-3-16-10(15)6-4-5-9-7-17-11(13-9)12-8(2)14/h7H,3-6H2,1-2H3,(H,12,13,14) |
| InChIKey | BSSANDYDYWUBPR-UHFFFAOYSA-N |
| Mol Weight | 256.32 g/mol |
| Molecular Formula | C11H16N2O3S |
| Exact Mass | 256.088164 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DOBk40cOx3H |
|---|---|
| Name | 4-(2-Acetamido-4-thiazolyl)butanoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.088163554 u |
| Formula | C11H16N2O3S |
| InChI | InChI=1S/C11H16N2O3S/c1-3-16-10(15)6-4-5-9-7-17-11(13-9)12-8(2)14/h7H,3-6H2,1-2H3,(H,12,13,14) |
| InChIKey | BSSANDYDYWUBPR-UHFFFAOYSA-N |
| Molecular Weight | 256.320 g/mol |
| SMILES | C1(=NC(CCCC(=O)OCC)=CS1)NC(=O)C |