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Glutaric acid, 3-methylbut-2-en-1-yl but-2-en-1-yl ester

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

Glutaric acid, 3-methylbut-2-en-1-yl but-2-en-1-yl ester
SpectraBase Compound ID BaS06tB7f27
InChI InChI=1S/C14H22O4/c1-4-5-10-17-13(15)7-6-8-14(16)18-11-9-12(2)3/h4-5,9H,6-8,10-11H2,1-3H3/b5-4+
InChIKey GUIKDOVUWAAMHC-SNAWJCMRSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Lo0dtZnhtGh
Name Glutaric acid, 3-methylbut-2-en-1-yl but-2-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.151809184 u
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-4-5-10-17-13(15)7-6-8-14(16)18-11-9-12(2)3/h4-5,9H,6-8,10-11H2,1-3H3/b5-4+
InChIKey GUIKDOVUWAAMHC-SNAWJCMRSA-N
Molecular Weight 254.326 g/mol
SMILES C(CCC(OCC=C(C)C)=O)C(OC\C=C\C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.950376