| SpectraBase Compound ID | 8M0QkVD0RhJ |
|---|---|
| InChI | InChI=1S/C6H9IO/c1-4(5(2)7)6(3)8/h1-3H3/b5-4- |
| InChIKey | IXDOUYAGAKWXPQ-PLNGDYQASA-N |
| Mol Weight | 224.04 g/mol |
| Molecular Formula | C6H9IO |
| Exact Mass | 223.96981 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1T8TxT6MR5e |
|---|---|
| Name | 4-Iodo-3-methyl-3-penten-2-one |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H9IO |
| InChI | InChI=1S/C6H9IO/c1-4(5(2)7)6(3)8/h1-3H3/b5-4- |
| InChIKey | IXDOUYAGAKWXPQ-PLNGDYQASA-N |
| Molecular Weight | 224.041 g/mol |
| SMILES | C\C(=C\(C(=O)C)C)I |
| SPLASH | splash10-0006-9010000000-b627eae146caef67b553 |
| Source of Spectrum | J-64-5328-12 |
| Synonyms | (3Z)-4-iodo-3-methyl-3-penten-2-one |
| Wiley ID | 1530657 |