| SpectraBase Compound ID | B6bYNX4RVaJ |
|---|---|
| InChI | InChI=1S/C8H14O4/c1-3-8(2,4-6(9)10)5-7(11)12/h3-5H2,1-2H3,(H,9,10)(H,11,12) |
| InChIKey | XAWFHZMTJUGGEE-UHFFFAOYSA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C8H14O4 |
| Exact Mass | 174.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BC5ylDDL4aB |
|---|---|
| Name | PENTANEDIOIC ACID, 3-ETHYL-3-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H14O4 |
| InChI | InChI=1S/C8H14O4/c1-3-8(2,4-6(9)10)5-7(11)12/h3-5H2,1-2H3,(H,9,10)(H,11,12) |
| InChIKey | XAWFHZMTJUGGEE-UHFFFAOYSA-N |
| Molecular Weight | 174.0888 |
| SMILES | OC(CC(CC(O)=O)(C)CC)=O |
| SPLASH | splash10-06dl-9100000000-f314e9436c2f367502ec |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |