| SpectraBase Compound ID | 7PEDyHi9Vgr |
|---|---|
| InChI | InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h5-6H,3-4,7H2,1-2H3/b8-5+ |
| InChIKey | RGAIVGKJOJFCTG-VMPITWQZSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C9H14O3 |
| Exact Mass | 170.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IGmbYOwUWdE |
|---|---|
| Name | ACETIC ACID, 3-METHYL-6-OXO-HEX-2-ENYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H14O3 |
| InChI | InChI=1S/C9H14O3/c1-8(4-3-6-10)5-7-12-9(2)11/h5-6H,3-4,7H2,1-2H3/b8-5+ |
| InChIKey | RGAIVGKJOJFCTG-VMPITWQZSA-N |
| Molecular Weight | 170.0939 |
| SMILES | CC(OC\C=C\(CCC=O)C)=O |
| SPLASH | splash10-000x-9100000000-dd1ce9ecf90a6c8d7284 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |