SpectraBase Compound ID | LsyfkARDia6 |
---|---|
InChI | InChI=1S/C11H16O3/c1-4-7-14-11-8-9(12-2)5-6-10(11)13-3/h5-6,8H,4,7H2,1-3H3 |
InChIKey | BZYJKIJHVMYXFL-UHFFFAOYSA-N |
Mol Weight | 196.25 g/mol |
Molecular Formula | C11H16O3 |
Exact Mass | 196.109944 g/mol |
SpectraBase Spectrum ID | CYfdYJIPzIk |
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Name | 1,4-Dimethoxy-2-propoxybenzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.109944372 u |
Formula | C11H16O3 |
InChI | InChI=1S/C11H16O3/c1-4-7-14-11-8-9(12-2)5-6-10(11)13-3/h5-6,8H,4,7H2,1-3H3 |
InChIKey | BZYJKIJHVMYXFL-UHFFFAOYSA-N |
Molecular Weight | 196.246 g/mol |
SMILES | C1=C(C(=CC(=C1)OC)OCCC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965681 |