SpectraBase Spectrum ID |
41AhXboAKyu |
Name |
Succinic acid, naphth-2-ylmethyl tetrahydrofurfuryl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.146723803 u |
Formula |
C20H22O5 |
InChI |
InChI=1S/C20H22O5/c21-19(9-10-20(22)25-14-18-6-3-11-23-18)24-13-15-7-8-16-4-1-2-5-17(16)12-15/h1-2,4-5,7-8,12,18H,3,6,9-11,13-14H2 |
InChIKey |
GKFACCNMXKWMAW-UHFFFAOYSA-N |
Molecular Weight |
342.391 g/mol |
SMILES |
C(CC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OCC1OCCC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972153 |