SpectraBase Spectrum ID |
HE3yi6omo09 |
Name |
Succinic acid, 1-cyclopentylethyl propyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
256.167459249 u |
Formula |
C14H24O4 |
InChI |
InChI=1S/C14H24O4/c1-3-10-17-13(15)8-9-14(16)18-11(2)12-6-4-5-7-12/h11-12H,3-10H2,1-2H3 |
InChIKey |
GVPIRELQCDEHPA-UHFFFAOYSA-N |
Molecular Weight |
256.342 g/mol |
SMILES |
C(CC(OC(C)C1CCCC1)=O)C(OCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954086 |