| SpectraBase Compound ID | 1cRTN4ddDw1 |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-16-10-7-5-9(6-8-10)11(13)3-2-4-12(14)15/h5-8H,2-4H2,1H3,(H,14,15) |
| InChIKey | UAMMMFTXGWKQLG-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8czjarAr1gt |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-16-10-7-5-9(6-8-10)11(13)3-2-4-12(14)15/h5-8H,2-4H2,1H3,(H,14,15) |
| InChIKey | UAMMMFTXGWKQLG-UHFFFAOYSA-N |
| Molecular Weight | 222.0888 |
| SMILES | OC(CCCC(=O)c1ccc(OC)cc1)=O |
| SPLASH | splash10-000i-6900000000-ba9fd95ae70b2a75c9c9 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |