| SpectraBase Spectrum ID |
DpB84ZCBnz |
| Name |
4-Hydroxybenzoic acid, o-ethoxycarbonyl-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.084123546 u |
| Formula |
C12H14O5 |
| InChI |
InChI=1S/C12H14O5/c1-3-15-11(13)9-5-7-10(8-6-9)17-12(14)16-4-2/h5-8H,3-4H2,1-2H3 |
| InChIKey |
XJFMZLYURKGANS-UHFFFAOYSA-N |
| Molecular Weight |
238.239 g/mol |
| SMILES |
C1=CC(=CC=C1C(=O)OCC)OC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969076 |
