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SpectraBase Compound ID | AtPIbtkfdTq |
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InChI | InChI=1S/C17H18O5/c1-21-12-5-3-11(4-6-12)9-16(19)17(20)14-8-7-13(22-2)10-15(14)18/h3-8,10,16,18-19H,9H2,1-2H3 |
InChIKey | PPOABILDHKLUET-UHFFFAOYSA-N |
Mol Weight | 302.33 g/mol |
Molecular Formula | C17H18O5 |
Exact Mass | 302.115424 g/mol |
SpectraBase Spectrum ID | 9fn4fv7Kwfu |
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Name | 1-(4-Methoxy-2-oxidanyl-phenyl)-3-(4-methoxyphenyl)-2-oxidanyl-propan-1-one |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 302.115423675 u |
Formula | C17H18O5 |
InChI | InChI=1S/C17H18O5/c1-21-12-5-3-11(4-6-12)9-16(19)17(20)14-8-7-13(22-2)10-15(14)18/h3-8,10,16,18-19H,9H2,1-2H3 |
InChIKey | PPOABILDHKLUET-UHFFFAOYSA-N |
SMILES | C=1(C(C(CC=2C=CC(=CC2)OC)O)=O)C(=CC(=CC1)OC)O |