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Adipic acid, di(trans-hex-3-enyl) ester

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

Adipic acid, di(trans-hex-3-enyl) ester
SpectraBase Compound ID JCgSYG69F7v
InChI InChI=1S/C18H30O4/c1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h5-8H,3-4,9-16H2,1-2H3/b7-5+,8-6+
InChIKey GFIBZYMYJRJLBF-KQQUZDAGSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GN0OWCvtDiI
Name Adipic acid, di(trans-hex-3-enyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.214409442 u
Formula C18H30O4
InChI InChI=1S/C18H30O4/c1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h5-8H,3-4,9-16H2,1-2H3/b7-5+,8-6+
InChIKey GFIBZYMYJRJLBF-KQQUZDAGSA-N
SMILES C(CCCC(OCC\C=C\CC)=O)C(OCC\C=C\CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.984918