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Succinic acid, 2-ethylhexyl 3-methylbut-2-en-1-yl ester

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

Succinic acid, 2-ethylhexyl 3-methylbut-2-en-1-yl ester
SpectraBase Compound ID LX8FLqpl2Ql
InChI InChI=1S/C17H30O4/c1-5-7-8-15(6-2)13-21-17(19)10-9-16(18)20-12-11-14(3)4/h11,15H,5-10,12-13H2,1-4H3
InChIKey KIOHRQQHCRAHDI-UHFFFAOYSA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CwAyoalFXmK
Name Succinic acid, 2-ethylhexyl 3-methylbut-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 298.214409442 u
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-5-7-8-15(6-2)13-21-17(19)10-9-16(18)20-12-11-14(3)4/h11,15H,5-10,12-13H2,1-4H3
InChIKey KIOHRQQHCRAHDI-UHFFFAOYSA-N
SMILES C(CC(OCC(CC)CCCC)=O)C(OCC=C(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970169