| SpectraBase Compound ID | Axs6XnBSTeR |
|---|---|
| InChI | InChI=1S/C12H18O3/c1-8-7-9(2)11(15)12(3,10(8)14)5-4-6-13/h6,8-9H,4-5,7H2,1-3H3 |
| InChIKey | HAPUSYPGGAHFSC-UHFFFAOYSA-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 | 3UA5IcK4yvZ |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18O3 |
| InChI | InChI=1S/C12H18O3/c1-8-7-9(2)11(15)12(3,10(8)14)5-4-6-13/h6,8-9H,4-5,7H2,1-3H3 |
| InChIKey | HAPUSYPGGAHFSC-UHFFFAOYSA-N |
| Molecular Weight | 210.1251 |
| SMILES | C1(CCC=O)(C)C(=O)C(C)CC(C)C1=O |
| SPLASH | splash10-05mo-9500000000-de140c395aec2048969e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |