| SpectraBase Spectrum ID |
6EOpSVAxTaH |
| Name |
Succinic acid, butyl 2-methoxybenzyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.146723803 u |
| Formula |
C16H22O5 |
| InChI |
InChI=1S/C16H22O5/c1-3-4-11-20-15(17)9-10-16(18)21-12-13-7-5-6-8-14(13)19-2/h5-8H,3-4,9-12H2,1-2H3 |
| InChIKey |
ZHAWFDVZLOJWDP-UHFFFAOYSA-N |
| Molecular Weight |
294.347 g/mol |
| SMILES |
C(CCC(OCC=1C(OC)=CC=CC1)=O)(OCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899066 |
