| SpectraBase Compound ID | 3xOyyiFLNdC |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-6(2)8-4-7(3)11-9(10)5-8/h6-8H,4-5H2,1-3H3 |
| InChIKey | DQYQBJFONWXLNI-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6G09oKqmykK |
|---|---|
| Name | 3-Isopropyl-5-methylvalerolactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-6(2)8-4-7(3)11-9(10)5-8/h6-8H,4-5H2,1-3H3 |
| InChIKey | DQYQBJFONWXLNI-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C1(OC(C)CC(C1)C(C)C)=O |
| SPLASH | splash10-044i-9500000000-2cdcda7fa7244bc80232 |
| Source of Spectrum | J-57-4703-34 |
| Synonyms | 4-isopropyl-6-methyltetrahydro-2H-pyran-2-one |
| Wiley ID | 1153873 |