| SpectraBase Compound ID | 3c2pjWPcODb |
|---|---|
| InChI | InChI=1S/C12H18O6/c1-11(2)14-5-6(16-11)7-8-9(10(13)15-7)18-12(3,4)17-8/h6-9H,5H2,1-4H3 |
| InChIKey | OFZPAXSEAVOAKB-UHFFFAOYSA-N |
| Mol Weight | 258.27 g/mol |
| Molecular Formula | C12H18O6 |
| Exact Mass | 258.110338 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 26Bf422sFVj |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18O6 |
| InChI | InChI=1S/C12H18O6/c1-11(2)14-5-6(16-11)7-8-9(10(13)15-7)18-12(3,4)17-8/h6-9H,5H2,1-4H3 |
| InChIKey | OFZPAXSEAVOAKB-UHFFFAOYSA-N |
| Molecular Weight | 258.1098 |
| SMILES | C1(OC(C2OC(OC12)(C)C)C1COC(C)(C)O1)=O |
| SPLASH | splash10-0006-9330000000-d64a9004d00eb3dc2527 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |