| SpectraBase Spectrum ID |
7prAyMVIfUg |
| Name |
Ethyl 5-(3,4-dimethoxyphenyl)pentanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.151809184 u |
| Formula |
C15H22O4 |
| InChI |
InChI=1S/C15H22O4/c1-4-19-15(16)8-6-5-7-12-9-10-13(17-2)14(11-12)18-3/h9-11H,4-8H2,1-3H3 |
| InChIKey |
RIHWSNKEPRRLJQ-UHFFFAOYSA-N |
| Molecular Weight |
266.337 g/mol |
| SMILES |
C=1(C(=CC=C(C1)CCCCC(=O)OCC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863753 |
