| SpectraBase Spectrum ID |
5RX3zrMQpGN |
| Name |
1,3-Benzodioxole, 5-ethoxy-6-(1-(4-methoxyphenyl)ethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.136159120 u |
| Formula |
C18H20O4 |
| InChI |
InChI=1S/C18H20O4/c1-4-20-16-10-18-17(21-11-22-18)9-15(16)12(2)13-5-7-14(19-3)8-6-13/h5-10,12H,4,11H2,1-3H3 |
| InChIKey |
ZXPUYXUKKDNJGZ-UHFFFAOYSA-N |
| Molecular Weight |
300.354 g/mol |
| SMILES |
C1(=C(C=C2C(=C1)OCO2)OCC)C(C1=CC=C(C=C1)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918639 |
