SpectraBase Spectrum ID |
AA7xTLkDDvP |
Name |
Succinic acid, butyl 2-phenoxyethyl 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/c1-2-3-11-20-15(17)9-10-16(18)21-13-12-19-14-7-5-4-6-8-14/h4-8H,2-3,9-13H2,1H3 |
InChIKey |
PCVAXHOILBFFCO-UHFFFAOYSA-N |
Molecular Weight |
294.347 g/mol |
SMILES |
C(CCC(OCCOC1=CC=CC=C1)=O)(OCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891997 |