| SpectraBase Compound ID | 2GaSIpKBBYU |
|---|---|
| InChI | InChI=1S/C9H9NO3/c1-2-9(11)7-5-3-4-6-8(7)10(12)13/h3-6H,2H2,1H3 |
| InChIKey | IRECTDZFQAWHEC-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 | m669asZmJs |
|---|---|
| Name | 1-(2-nitrophenyl)-1-propanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9NO3 |
| InChI | InChI=1S/C9H9NO3/c1-2-9(11)7-5-3-4-6-8(7)10(12)13/h3-6H,2H2,1H3 |
| InChIKey | IRECTDZFQAWHEC-UHFFFAOYSA-N |
| Molecular Weight | 179.175 g/mol |
| SMILES | C(CC)(=O)c1c(cccc1)N(=O)=O |
| SPLASH | splash10-0udi-2900000000-e240c9b705ab53481617 |
| Source of Spectrum | KC-0-906-2 |
| Synonyms | 1-(2-nitrophenyl)propan-1-one |
| Wiley ID | 781115 |