| SpectraBase Compound ID | 8q8RiVzMZjr |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-6(2)4-3-5-7(8)9/h4H,3,5H2,1-2H3,(H,8,9) |
| InChIKey | YJJLHGCCADOOPZ-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | dxF88g76Xu |
|---|---|
| Name | 5-methylhex-4-enoic acid |
| Appearance | Oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-6(2)4-3-5-7(8)9/h4H,3,5H2,1-2H3,(H,8,9) |
| InChIKey | YJJLHGCCADOOPZ-UHFFFAOYSA-N |
| Instrument Name | Shimadzu GCMS-QP2010S |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/ejoc.201900356 |
| Molecular Weight | 128.171 g/mol |
| SMILES | OC(CCC=C(C)C)=O |
| SPLASH | splash10-014l-9000000000-734e3dbc0f40fcd7b642 |
| Source of Spectrum | U1-2020-SM87-5a |
| Wiley ID | 1858765 |