SpectraBase Compound ID | 4FOi9LVmVva |
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InChI | InChI=1S/C11H10O3/c1-13-10-9(7-14-11(10)12)8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
InChIKey | COHOVQXPIFLINN-UHFFFAOYSA-N |
Mol Weight | 190.2 g/mol |
Molecular Formula | C11H10O3 |
Exact Mass | 190.062994 g/mol |
SpectraBase Spectrum ID | 7mu3mF7kze8 |
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Name | 2(5H)-Furanone, 3-methoxy-4-phenyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 190.062994179 u |
Formula | C11H10O3 |
InChI | InChI=1S/C11H10O3/c1-13-10-9(7-14-11(10)12)8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
InChIKey | COHOVQXPIFLINN-UHFFFAOYSA-N |
Molecular Weight | 190.198 g/mol |
SMILES | C1(=C(C(=O)OC1)OC)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.835496 |