| SpectraBase Compound ID | 1xOThixVSH1 |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-11(15)7-9-13(14(16)17)10-8-12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3 |
| InChIKey | UYJAXULRFNMSJW-UHFFFAOYSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 983oStAWExY |
|---|---|
| Name | 5-Nitro-7-phenylheptan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-11(15)7-9-13(14(16)17)10-8-12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3 |
| InChIKey | UYJAXULRFNMSJW-UHFFFAOYSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | CC(CCC(CCc1ccccc1)N(=O)=O)=O |
| SPLASH | splash10-0006-9300000000-9ab0916b32c440d50a19 |
| Source of Spectrum | F-68-5855-3ca |
| Wiley ID | 1717325 |