| SpectraBase Compound ID | L5NcXBgA6Qu |
|---|---|
| InChI | InChI=1S/C8H12O.C4H8O2/c9-8-4-6-1-2-7(3-6)5-8;1-3-6-4(2)5/h6-7H,1-5H2;3H2,1-2H3/t6-,7+; |
| InChIKey | GUGUQJPDEMKDMK-UKMDXRBESA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8SSujxhNZsF |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18O3 |
| InChI | InChI=1S/C8H12O.C4H8O2/c9-8-4-6-1-2-7(3-6)5-8;1-3-6-4(2)5/h6-7H,1-5H2;3H2,1-2H3/t6-,7+; |
| InChIKey | GUGUQJPDEMKDMK-UKMDXRBESA-N |
| Molecular Weight | 212.1407 |
| SMILES | CCOC(C)=O.C1[C@@]2(CC[C@]1(CC(=O)C2)[H])[H] |
| SPLASH | splash10-0006-9200000000-173ec4788af1e37c213e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |