| SpectraBase Compound ID | Dsw1TQjPA4G |
|---|---|
| InChI | InChI=1S/C11H10O6/c1-14-10(12)6-3-8-9(17-5-16-8)4-7(6)11(13)15-2/h3-4H,5H2,1-2H3 |
| InChIKey | VVUSFVVIAJXDRH-UHFFFAOYSA-N |
| Mol Weight | 238.19 g/mol |
| Molecular Formula | C11H10O6 |
| Exact Mass | 238.047738 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IawwjXFCt6q |
|---|---|
| Name | Dimethyl hydrastate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.047738036 u |
| Formula | C11H10O6 |
| InChI | InChI=1S/C11H10O6/c1-14-10(12)6-3-8-9(17-5-16-8)4-7(6)11(13)15-2/h3-4H,5H2,1-2H3 |
| InChIKey | VVUSFVVIAJXDRH-UHFFFAOYSA-N |
| Molecular Weight | 238.195 g/mol |
| SMILES | C1(=C(C=C2C(=C1)OCO2)C(OC)=O)C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.85591 |