SpectraBase Compound ID | 90G0uwFEtm7 |
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InChI | InChI=1S/C19H20O2/c1-3-18(20)16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)19(21)4-2/h5-12H,3-4,13H2,1-2H3 |
InChIKey | GPKZUYMYXAPFFA-UHFFFAOYSA-N |
Mol Weight | 280.37 g/mol |
Molecular Formula | C19H20O2 |
Exact Mass | 280.14633 g/mol |
SpectraBase Spectrum ID | KPdhv87LkjS |
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Name | 4',4'''-methylenedipropiophenone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 280.146329882 u |
Formula | C19H20O2 |
InChI | InChI=1S/C19H20O2/c1-3-18(20)16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)19(21)4-2/h5-12H,3-4,13H2,1-2H3 |
InChIKey | GPKZUYMYXAPFFA-UHFFFAOYSA-N |
SMILES | C1=C(C=CC(=C1)C(CC)=O)CC=1C=CC(=CC1)C(CC)=O |
Spectrum/Structure Validation Score (Raman) | 0.987037 |