SpectraBase Compound ID | Imn0T7aJC3C |
---|---|
InChI | InChI=1S/C16H14O4/c1-20-16-5-3-2-4-11(16)6-9-14(18)13-8-7-12(17)10-15(13)19/h2-10,17,19H,1H3/b9-6+ |
InChIKey | ODLVGCCGMXGMGZ-RMKNXTFCSA-N |
Mol Weight | 270.28 g/mol |
Molecular Formula | C16H14O4 |
Exact Mass | 270.089209 g/mol |
SpectraBase Spectrum ID | FlkxIm6zLw1 |
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Name | 2',4'-Dihydroxy-4-methoxychalcone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 270.089208927 u |
Formula | C16H14O4 |
InChI | InChI=1S/C16H14O4/c1-20-16-5-3-2-4-11(16)6-9-14(18)13-8-7-12(17)10-15(13)19/h2-10,17,19H,1H3/b9-6+ |
InChIKey | ODLVGCCGMXGMGZ-RMKNXTFCSA-N |
SMILES | C1(O)=C(C(=O)\C=C\C2=C(OC)C=CC=C2)C=CC(=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841969 |