| SpectraBase Compound ID | uoM0Gr4q1A |
|---|---|
| InChI | InChI=1S/C8H16O/c1-3-5-8(2)6-4-7-9/h7-8H,3-6H2,1-2H3 |
| InChIKey | KQXBFBQRLHMLIS-UHFFFAOYSA-N |
| Mol Weight | 128.21 g/mol |
| Molecular Formula | C8H16O |
| Exact Mass | 128.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5TmBfJ3Zu3B |
|---|---|
| Name | 4-Methylheptanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-3-5-8(2)6-4-7-9/h7-8H,3-6H2,1-2H3 |
| InChIKey | KQXBFBQRLHMLIS-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cbdv.201600020 |
| Molecular Weight | 128.215 g/mol |
| SMILES | C(CCC(CCC)C)=O |
| SPLASH | splash10-0a4l-9000000000-bc412841c84cf316bbf3 |
| Source of Spectrum | CBD-13-1218-29 |
| Wiley ID | 1803576 |