| SpectraBase Compound ID | 6K9zRFj4mEG |
|---|---|
| InChI | InChI=1S/C11H10N2O3/c1-2-16-11(15)9(13-12)10(14)8-6-4-3-5-7-8/h3-7H,2H2,1H3 |
| InChIKey | UORPZKSQFCKMOW-UHFFFAOYSA-N |
| Mol Weight | 218.21 g/mol |
| Molecular Formula | C11H10N2O3 |
| Exact Mass | 218.069142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3nBc7PTQa1u |
|---|---|
| Name | Benzenepropanoic acid, .alpha.-diazo-.beta.-oxo-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.069142187 u |
| Formula | C11H10N2O3 |
| InChI | InChI=1S/C11H10N2O3/c1-2-16-11(15)9(13-12)10(14)8-6-4-3-5-7-8/h3-7H,2H2,1H3 |
| InChIKey | UORPZKSQFCKMOW-UHFFFAOYSA-N |
| Molecular Weight | 218.212 g/mol |
| SMILES | C(C(=O)C1=CC=CC=C1)(C(OCC)=O)=N#N |