| SpectraBase Compound ID | CPRBXRxUByh |
|---|---|
| InChI | InChI=1S/C13H22O5/c1-6-17-11(15)8-13(9(3)4,10(5)14)12(16)18-7-2/h9H,6-8H2,1-5H3 |
| InChIKey | FLWKQLCCYVGHDM-UHFFFAOYSA-N |
| Mol Weight | 258.31 g/mol |
| Molecular Formula | C13H22O5 |
| Exact Mass | 258.146724 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DTxQc10qYB9 |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C13H22O5 |
| InChI | InChI=1S/C13H22O5/c1-6-17-11(15)8-13(9(3)4,10(5)14)12(16)18-7-2/h9H,6-8H2,1-5H3 |
| InChIKey | FLWKQLCCYVGHDM-UHFFFAOYSA-N |
| Molecular Weight | 258.1461 |
| SMILES | C(OC(C(CC(OCC)=O)(C(C)C)C(=O)C)=O)C |
| SPLASH | splash10-07ou-8930000000-47f220062bd3e7d9461c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |