| SpectraBase Compound ID | DytWISVMCBf |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-6(5-9)4-7(2)8(10)11-3/h5-7H,4H2,1-3H3 |
| InChIKey | OKNRJVQZLSTJEB-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6WqOJ6sKntx |
|---|---|
| Name | PENTANOIC ACID, 2,4-DIMETHYL-5-OXO-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-6(5-9)4-7(2)8(10)11-3/h5-7H,4H2,1-3H3 |
| InChIKey | OKNRJVQZLSTJEB-UHFFFAOYSA-N |
| Molecular Weight | 158.0939 |
| SMILES | COC(C(CC(C=O)C)C)=O |
| SPLASH | splash10-0a4u-9200000000-a1165c085d212c3814cc |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |