| SpectraBase Compound ID | Fy1lVlY0guJ |
|---|---|
| InChI | InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | GEKRISJWBAIIAA-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JEQAbfjSBfG |
|---|---|
| Name | Hexanal, 5-methyl- |
| Alternate Name(s) | 5-Methylhexanal 5-Methylhexan-1-al |
| CAS Registry Number | 1860-39-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | GEKRISJWBAIIAA-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(CCC=O)C(C)C |
| SPLASH | splash10-0006-9000000000-16a329ab2367c8bcc946 |
| Source of Spectrum | SD-1981-0-0 |
| Wiley ID | 1124601 |