| SpectraBase Compound ID | LnDVgErkyl1 |
|---|---|
| InChI | InChI=1S/C7H14O/c1-3-7(2)5-4-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | GIGNTOMJQYNUNL-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 | 7P22uLntozj |
|---|---|
| Name | Hexanal, 4-methyl- |
| Alternate Name(s) | 4-Methylhexanal |
| CAS Registry Number | 41065-97-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-3-7(2)5-4-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | GIGNTOMJQYNUNL-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(CCC=O)(CC)C |
| SPLASH | splash10-0adl-9000000000-1d26f35c6710e1b7e0e2 |
| Source of Spectrum | SD-1981-0-0 |
| Wiley ID | 1124600 |