| SpectraBase Compound ID | LerZkRJXEjT |
|---|---|
| InChI | InChI=1S/C15H14O4/c1-18-14-12(16)9-11(13(17)15(14)19-2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChIKey | LMRJKMLHIDEOQP-UHFFFAOYSA-N |
| Mol Weight | 258.27 g/mol |
| Molecular Formula | C15H14O4 |
| Exact Mass | 258.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9oIM5aOI2mA |
|---|---|
| Name | 2,3-Dimethoxy-5-(phenylmethyl)cyclohexa-2,5-diene-1,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.089208927 u |
| Formula | C15H14O4 |
| InChI | InChI=1S/C15H14O4/c1-18-14-12(16)9-11(13(17)15(14)19-2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChIKey | LMRJKMLHIDEOQP-UHFFFAOYSA-N |
| Molecular Weight | 258.273 g/mol |
| SMILES | C1(=C(C(=O)C=C(C1=O)CC=1C=CC=CC1)OC)OC |