| SpectraBase Compound ID | JL2xHQpTnj |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-3-14-11-7-5-6-10(8-11)9-12(13)15-4-2/h8-9H,3-7H2,1-2H3/b10-9+ |
| InChIKey | JRNDIFWWSQHNFF-MDZDMXLPSA-N |
| Mol Weight | 210.27 g/mol |
| Molecular Formula | C12H18O3 |
| Exact Mass | 210.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1jm8QWuWKBw |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-3-14-11-7-5-6-10(8-11)9-12(13)15-4-2/h8-9H,3-7H2,1-2H3/b10-9+ |
| InChIKey | JRNDIFWWSQHNFF-MDZDMXLPSA-N |
| Molecular Weight | 210.1251 |
| SMILES | C1CC\C(=C/C(OCC)=O)C=C1OCC |
| SPLASH | splash10-01p9-4910000000-74cd800fd3d534a1175b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |