SpectraBase Compound ID | 29Qm6hB8ZSx |
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InChI | InChI=1S/C17H16O3/c1-19-16-11-9-14(12-17(16)20-2)15(18)10-8-13-6-4-3-5-7-13/h3-12H,1-2H3 |
InChIKey | DJUDWUHRZBILKP-UHFFFAOYSA-N |
Mol Weight | 268.31 g/mol |
Molecular Formula | C17H16O3 |
Exact Mass | 268.109944 g/mol |
SpectraBase Spectrum ID | H29SVaAHaqY |
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Name | 3',4'-Dimethoxychalcone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.109944372 u |
Formula | C17H16O3 |
InChI | InChI=1S/C17H16O3/c1-19-16-11-9-14(12-17(16)20-2)15(18)10-8-13-6-4-3-5-7-13/h3-12H,1-2H3 |
InChIKey | DJUDWUHRZBILKP-UHFFFAOYSA-N |
Molecular Weight | 268.312 g/mol |
SMILES | C=1C=C(C=C(C1OC)OC)C(C=CC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Raman) | 0.988786 |