| SpectraBase Compound ID | EPqnGlP3kh6 |
|---|---|
| InChI | InChI=1S/C12H13NO3/c1-9(14)13(10(2)15)8-12(16)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3 |
| InChIKey | TVZSCIIQDUFHDJ-UHFFFAOYSA-N |
| Mol Weight | 219.24 g/mol |
| Molecular Formula | C12H13NO3 |
| Exact Mass | 219.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L4iJDmX2tqE |
|---|---|
| Name | 2-Amino-1-phenylethanone 2ac |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.089543280 u |
| Formula | C12H13NO3 |
| InChI | InChI=1S/C12H13NO3/c1-9(14)13(10(2)15)8-12(16)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3 |
| InChIKey | TVZSCIIQDUFHDJ-UHFFFAOYSA-N |
| Molecular Weight | 219.240 g/mol |
| SMILES | C(N(C(=O)C)C(=O)C)C(C=1C=CC=CC1)=O |