| SpectraBase Compound ID | 4Auy1lqfqTD |
|---|---|
| InChI | InChI=1S/C9H9NO3/c1-7(11)6-8-2-4-9(5-3-8)10(12)13/h2-5H,6H2,1H3 |
| InChIKey | GEWWCWZGHNIUBW-UHFFFAOYSA-N |
| Mol Weight | 179.17 g/mol |
| Molecular Formula | C9H9NO3 |
| Exact Mass | 179.058243 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C8f9ejvkLT7 |
|---|---|
| Name | 1-(4-Nitrophenyl)propan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9NO3 |
| InChI | InChI=1S/C9H9NO3/c1-7(11)6-8-2-4-9(5-3-8)10(12)13/h2-5H,6H2,1H3 |
| InChIKey | GEWWCWZGHNIUBW-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/adsc.201800427 |
| Molecular Weight | 179.175 g/mol |
| SMILES | c1([N+](=O)[O-])ccc(cc1)CC(C)=O |
| SPLASH | splash10-000i-1900000000-ace488e5f9899c9dbc6e |
| Source of Spectrum | ASC-360-SM8-3a |
| Wiley ID | 1811907 |