| SpectraBase Compound ID | GfyyQJbSUMN |
|---|---|
| InChI | InChI=1S/C9H15NO3/c1-4-5-9(8(3)11)6-7(2)10(12)13/h5,7H,4,6H2,1-3H3/b9-5+ |
| InChIKey | CDZJIGPYIRNJFX-WEVVVXLNSA-N |
| Mol Weight | 185.22 g/mol |
| Molecular Formula | C9H15NO3 |
| Exact Mass | 185.105193 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A0lWeeE4eLS |
|---|---|
| Name | (E)-3-(2-nitropropyl)-3-hexen-2-one |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15NO3 |
| InChI | InChI=1S/C9H15NO3/c1-4-5-9(8(3)11)6-7(2)10(12)13/h5,7H,4,6H2,1-3H3/b9-5+ |
| InChIKey | CDZJIGPYIRNJFX-WEVVVXLNSA-N |
| Molecular Weight | 185.223 g/mol |
| SMILES | C(N(=O)=O)(C\C(C(=O)C)=C/CC)C |
| SPLASH | splash10-0006-9400000000-caab0f49e686a98529e9 |
| Source of Spectrum | SO-0-297-2 |
| Synonyms | (E)-3-(2-nitropropyl)hex-3-en-2-one |
| Wiley ID | 877327 |