SpectraBase Compound ID | CEz1G82AAqc |
---|---|
InChI | InChI=1S/C11H14O2/c1-4-5-9-8-10(12-2)6-7-11(9)13-3/h4,6-8H,1,5H2,2-3H3 |
InChIKey | FRYMRMPLKQWKEP-UHFFFAOYSA-N |
Mol Weight | 178.23 g/mol |
Molecular Formula | C11H14O2 |
Exact Mass | 178.09938 g/mol |
SpectraBase Spectrum ID | hH4AhQKDcu |
---|---|
Name | 2-Allyl-1,4-dimethoxybenzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 178.099379689 u |
Formula | C11H14O2 |
InChI | InChI=1S/C11H14O2/c1-4-5-9-8-10(12-2)6-7-11(9)13-3/h4,6-8H,1,5H2,2-3H3 |
InChIKey | FRYMRMPLKQWKEP-UHFFFAOYSA-N |
Molecular Weight | 178.231 g/mol |
SMILES | C1=CC(=C(C=C1OC)CC=C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966108 |