| SpectraBase Compound ID | GcOLyyafhv2 |
|---|---|
| InChI | InChI=1S/C9H18O2/c1-4-5-6-8(2)7-9(10)11-3/h8H,4-7H2,1-3H3 |
| InChIKey | GZLDPMXJNRMXQC-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 | FV6ExZlCYEn |
|---|---|
| Name | Methyl 3-methylheptanoate |
| Alternate Name(s) | 3-Methylheptanoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H18O2 |
| InChI | InChI=1S/C9H18O2/c1-4-5-6-8(2)7-9(10)11-3/h8H,4-7H2,1-3H3 |
| InChIKey | GZLDPMXJNRMXQC-UHFFFAOYSA-N |
| Molecular Weight | 158.241 g/mol |
| SMILES | C(CC(CCCC)C)(=O)OC |
| SPLASH | splash10-00di-9100000000-e4ab85ccce140e52fc39 |
| Source of Spectrum | QC-23-855-6 |
| Wiley ID | 1738786 |