| SpectraBase Compound ID | CNemThYpyp2 |
|---|---|
| InChI | InChI=1S/C7H10O3/c1-5(8)4-6(2)10-7(3)9/h4H,1-3H3/b6-4+ |
| InChIKey | LBQVXEZJUOFPFA-GQCTYLIASA-N |
| Mol Weight | 142.15 g/mol |
| Molecular Formula | C7H10O3 |
| Exact Mass | 142.062994 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKgANVqHrHY |
|---|---|
| Name | ACETIC ACID, 1-METHYL-3-OXOBUT-1-ENYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H10O3 |
| InChI | InChI=1S/C7H10O3/c1-5(8)4-6(2)10-7(3)9/h4H,1-3H3/b6-4+ |
| InChIKey | LBQVXEZJUOFPFA-GQCTYLIASA-N |
| Molecular Weight | 142.0627 |
| SMILES | CC(O\C(=C\C(C)=O)C)=O |
| SPLASH | splash10-0006-9100000000-e4424be3c8ae51a068e3 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |