| SpectraBase Compound ID | JjUZNY2bWuy |
|---|---|
| InChI | InChI=1S/C12H13NO4/c1-3-11(14)8(2)12(15)9-5-4-6-10(7-9)13(16)17/h4-7,12,15H,2-3H2,1H3 |
| InChIKey | GAPRQAUABRCPKN-UHFFFAOYSA-N |
| Mol Weight | 235.24 g/mol |
| Molecular Formula | C12H13NO4 |
| Exact Mass | 235.084458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IrPbnzITypn |
|---|---|
| Name | 5-Hydroxy-5-(m-nitrophenyl)-4-methylenebutan-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO4 |
| InChI | InChI=1S/C12H13NO4/c1-3-11(14)8(2)12(15)9-5-4-6-10(7-9)13(16)17/h4-7,12,15H,2-3H2,1H3 |
| InChIKey | GAPRQAUABRCPKN-UHFFFAOYSA-N |
| Molecular Weight | 235.239 g/mol |
| SMILES | OC(C(C(=O)CC)=C)c1cc(N(=O)=O)ccc1 |
| SPLASH | splash10-066r-0190000000-26c6e988f5e8e854b004 |
| Source of Spectrum | F-59-1188-4b |
| Wiley ID | 1712126 |