SpectraBase Compound ID | 28K7XdTOEhQ |
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InChI | InChI=1S/C11H14O3/c1-11(2)6-7-4-10(13-3)8(12)5-9(7)14-11/h4-5,12H,6H2,1-3H3 |
InChIKey | ACQYPIAXRFUNKF-UHFFFAOYSA-N |
Mol Weight | 194.23 g/mol |
Molecular Formula | C11H14O3 |
Exact Mass | 194.094294 g/mol |
SpectraBase Spectrum ID | 1KiHwiV7TTr |
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Name | 2-Methyl-5-methoxy-6-hydroxybenzofuran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.094294308 u |
Formula | C11H14O3 |
InChI | InChI=1S/C11H14O3/c1-11(2)6-7-4-10(13-3)8(12)5-9(7)14-11/h4-5,12H,6H2,1-3H3 |
InChIKey | ACQYPIAXRFUNKF-UHFFFAOYSA-N |
Molecular Weight | 194.230 g/mol |
SMILES | C1=2OC(C)(C)CC2C=C(C(=C1)O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.877125 |