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Fumaric acid, di(pent-4-enyl) ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Fumaric acid, di(pent-4-enyl) ester
SpectraBase Compound ID DpQR2rFQDja
InChI InChI=1S/C14H20O4/c1-3-5-7-11-17-13(15)9-10-14(16)18-12-8-6-4-2/h3-4,9-10H,1-2,5-8,11-12H2/b10-9+
InChIKey AUCLTYLEVXSTDN-MDZDMXLPSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 58lacZDlQ3J
Name Fumaric acid, di(pent-4-enyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.136159120 u
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-3-5-7-11-17-13(15)9-10-14(16)18-12-8-6-4-2/h3-4,9-10H,1-2,5-8,11-12H2/b10-9+
InChIKey AUCLTYLEVXSTDN-MDZDMXLPSA-N
Molecular Weight 252.310 g/mol
SMILES C(\C=C\C(OCCCC=C)=O)(OCCCC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.974661