| SpectraBase Compound ID | CLWnfADJe8K |
|---|---|
| InChI | InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | ZSJUABCTGCNBPF-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 | JF8bkRJS3e0 |
|---|---|
| Name | Hexanal, 3-methyl- |
| CAS Registry Number | 19269-28-4 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-3-4-7(2)5-6-8/h6-7H,3-5H2,1-2H3 |
| InChIKey | ZSJUABCTGCNBPF-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(=O)CC(CCC)C |
| SPLASH | splash10-006x-9000000000-2e8e9ff4560a29f3e914 |
| Source of Spectrum | AA-0-400-5 |
| Synonyms | 3-Methylhexanal 3-Methyl hexanal |
| Wiley ID | 3250 |