| SpectraBase Compound ID | 7zZwPevFTX9 |
|---|---|
| InChI | InChI=1S/C9H12O3/c1-5-4-6(2)8(10)7(5)9(11)12-3/h6H,4H2,1-3H3 |
| InChIKey | DNFNYLJBXRQADU-UHFFFAOYSA-N |
| Mol Weight | 168.19 g/mol |
| Molecular Formula | C9H12O3 |
| Exact Mass | 168.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3pd9CjvHmwD |
|---|---|
| Name | Methyl 2,4-Dimethyl-5-oxocyclopent-1-enecarboxylate |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12O3 |
| InChI | InChI=1S/C9H12O3/c1-5-4-6(2)8(10)7(5)9(11)12-3/h6H,4H2,1-3H3 |
| InChIKey | DNFNYLJBXRQADU-UHFFFAOYSA-N |
| Molecular Weight | 168.192 g/mol |
| SMILES | C1(=C(CC(C1=O)C)C)C(=O)OC |
| SPLASH | splash10-00kr-0900000000-eff7b5d3b1802753d2b9 |
| Source of Spectrum | F4-42-3667-2d |
| Wiley ID | 1674476 |