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Glutaric acid, 3-methylbut-2-yl 2-methylpent-3-yl ester

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

Glutaric acid, 3-methylbut-2-yl 2-methylpent-3-yl ester
SpectraBase Compound ID 3FGwT5Q0Zer
InChI InChI=1S/C16H30O4/c1-7-14(12(4)5)20-16(18)10-8-9-15(17)19-13(6)11(2)3/h11-14H,7-10H2,1-6H3
InChIKey DDSJLMZLUBZRMM-UHFFFAOYSA-N
Mol Weight 286.41 g/mol
Molecular Formula C16H30O4
Exact Mass 286.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID C77GmeBt7gx
Name Glutaric acid, 3-methylbut-2-yl 2-methylpent-3-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.214409442 u
Formula C16H30O4
InChI InChI=1S/C16H30O4/c1-7-14(12(4)5)20-16(18)10-8-9-15(17)19-13(6)11(2)3/h11-14H,7-10H2,1-6H3
InChIKey DDSJLMZLUBZRMM-UHFFFAOYSA-N
SMILES C(CCC(OC(C(C)C)C)=O)C(OC(C(C)C)CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.800508