| SpectraBase Compound ID | CyVXcI4kfhz |
|---|---|
| InChI | InChI=1S/C8H10N2O3S/c11-6(2-1-3-7(12)13)10-8-9-4-5-14-8/h4-5H,1-3H2,(H,12,13)(H,9,10,11) |
| InChIKey | KIGCPAJFAFXJHS-UHFFFAOYSA-N |
| Mol Weight | 214.24 g/mol |
| Molecular Formula | C8H10N2O3S |
| Exact Mass | 214.041213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8mstHBXW5dJ |
|---|---|
| Name | N-(2-Thiazolyl)glutaramic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.041213361 u |
| Formula | C8H10N2O3S |
| InChI | InChI=1S/C8H10N2O3S/c11-6(2-1-3-7(12)13)10-8-9-4-5-14-8/h4-5H,1-3H2,(H,12,13)(H,9,10,11) |
| InChIKey | KIGCPAJFAFXJHS-UHFFFAOYSA-N |
| Molecular Weight | 214.239 g/mol |
| SMILES | N(C=1SC=CN1)C(CCCC(O)=O)=O |