| SpectraBase Compound ID | EUDhFkD6Q5h |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11) |
| InChIKey | XZOYHFBNQHPJRQ-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C9H18O2 |
| Exact Mass | 158.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5NkuExG6iJ3 |
|---|---|
| Name | 7-Methyloctanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-8(2)6-4-3-5-7-9(10)11/h8H,3-7H2,1-2H3,(H,10,11) |
| InChIKey | XZOYHFBNQHPJRQ-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cbic.200900126 |
| Molecular Weight | 158.241 g/mol |
| SMILES | OC(CCCCCC(C)C)=O |
| SPLASH | splash10-0603-9100000000-dc9627c09fbb7c337257 |
| Source of Spectrum | CBC-10-1861/SM3-2 |
| Wiley ID | 1786613 |