| SpectraBase Compound ID | 8ICkUShmhMS |
|---|---|
| InChI | InChI=1S/C13H16O4/c1-13(2)16-9-11(17-13)8-15-12(14)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3 |
| InChIKey | YOMCVAULZUXXDS-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C13H16O4 |
| Exact Mass | 236.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 56pcCxcstVS |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16O4 |
| InChI | InChI=1S/C13H16O4/c1-13(2)16-9-11(17-13)8-15-12(14)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3 |
| InChIKey | YOMCVAULZUXXDS-UHFFFAOYSA-N |
| Molecular Weight | 236.1044 |
| SMILES | c1(C(OCC2COC(C)(C)O2)=O)ccccc1 |
| SPLASH | splash10-0ab9-6950000000-b4e36110f61f323a336a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |