| SpectraBase Compound ID | 7bXu4pfgbw1 |
|---|---|
| InChI | InChI=1S/C12H20O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h10H,3,5-8H2,1-2,4H3 |
| InChIKey | XXFIWAJVJUCXKQ-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C12H20O4 |
| Exact Mass | 228.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ccjk3CBTiwk |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H20O4 |
| InChI | InChI=1S/C12H20O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h10H,3,5-8H2,1-2,4H3 |
| InChIKey | XXFIWAJVJUCXKQ-UHFFFAOYSA-N |
| Instrument Name | TSQ700 |
| Molecular Weight | 228.1356 |
| SMILES | CC(=C)CCC(C(OCC)=O)C(OCC)=O |
| SPLASH | splash10-056r-9200000000-fa5b0fa45ac3a9fa725b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |