| SpectraBase Compound ID | 53JjI0bqGY |
|---|---|
| InChI | InChI=1S/C12H15NO3/c1-8(2)12(9(3)14)10-4-6-11(7-5-10)13(15)16/h4-8,12H,1-3H3 |
| InChIKey | ZFBDAZARKAESQO-UHFFFAOYSA-N |
| Mol Weight | 221.26 g/mol |
| Molecular Formula | C12H15NO3 |
| Exact Mass | 221.105193 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2Ssb4eO4Yq |
|---|---|
| Name | 4-Methyl-3-(4-nitrophenyl)-2-pentanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15NO3 |
| InChI | InChI=1S/C12H15NO3/c1-8(2)12(9(3)14)10-4-6-11(7-5-10)13(15)16/h4-8,12H,1-3H3 |
| InChIKey | ZFBDAZARKAESQO-UHFFFAOYSA-N |
| Molecular Weight | 221.256 g/mol |
| SMILES | c1(N(=O)=O)ccc(C(C(=O)C)C(C)C)cc1 |
| SPLASH | splash10-002f-9800000000-bd255330b91044c31a38 |
| Source of Spectrum | B-32-1499-0 |
| Wiley ID | 1221230 |