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Glutaric acid, 3-methylbut-2-en-1-yl pent-4-en-2-yl ester

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

Glutaric acid, 3-methylbut-2-en-1-yl pent-4-en-2-yl ester
SpectraBase Compound ID 2PKquFKkK8R
InChI InChI=1S/C15H24O4/c1-5-7-13(4)19-15(17)9-6-8-14(16)18-11-10-12(2)3/h5,10,13H,1,6-9,11H2,2-4H3
InChIKey LNMJUPSIMBDMRN-UHFFFAOYSA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LmaXfjoMj1D
Name Glutaric acid, 3-methylbut-2-en-1-yl pent-4-en-2-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.167459249 u
Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-5-7-13(4)19-15(17)9-6-8-14(16)18-11-10-12(2)3/h5,10,13H,1,6-9,11H2,2-4H3
InChIKey LNMJUPSIMBDMRN-UHFFFAOYSA-N
Molecular Weight 268.353 g/mol
SMILES C(CCC(OCC=C(C)C)=O)C(OC(C)CC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908988