| SpectraBase Compound ID | DBwdySKrpXl |
|---|---|
| InChI | InChI=1S/C12H16O4/c1-7-6-9(14-3)8(2)11(15-4)10(7)12(13)16-5/h6H,1-5H3 |
| InChIKey | CISSOVGZBPRVEP-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C12H16O4 |
| Exact Mass | 224.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3VbohNbuNRg |
|---|---|
| Name | Veramoss, dimethyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.104858991 u |
| Formula | C12H16O4 |
| InChI | InChI=1S/C12H16O4/c1-7-6-9(14-3)8(2)11(15-4)10(7)12(13)16-5/h6H,1-5H3 |
| InChIKey | CISSOVGZBPRVEP-UHFFFAOYSA-N |
| Molecular Weight | 224.256 g/mol |
| SMILES | COC=1C(C)=C(OC)C=C(C)C1C(OC)=O |