| SpectraBase Compound ID | K3Q7yGN4Yjv |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-6(7(2)9)4-3-5-8(10)11/h6H,3-5H2,1-2H3,(H,10,11) |
| InChIKey | KAQNISRSBHMTHY-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7IOJ8l2iCyO |
|---|---|
| Name | 5-Methyl-6-oxoheptanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-6(7(2)9)4-3-5-8(10)11/h6H,3-5H2,1-2H3,(H,10,11) |
| InChIKey | KAQNISRSBHMTHY-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cber.19801130205 |
| Molecular Weight | 158.197 g/mol |
| SMILES | OC(CCCC(C(C)=O)C)=O |
| SPLASH | splash10-0006-9000000000-a77b9e7e374bafe5ec48 |
| Source of Spectrum | K-113-455-4 |
| Wiley ID | 1792668 |