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Diethyl 2-((1-oxaspiro[5.5]undecan-2-yl)methyl)malonate

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Diethyl 2-((1-oxaspiro[5.5]undecan-2-yl)methyl)malonate
SpectraBase Compound ID 3K5ZAly6GrP
InChI InChI=1S/C18H30O5/c1-3-21-16(19)15(17(20)22-4-2)13-14-9-8-12-18(23-14)10-6-5-7-11-18/h14-15H,3-13H2,1-2H3
InChIKey JPYBIAJAZIXZIQ-UHFFFAOYSA-N
Mol Weight 326.43 g/mol
Molecular Formula C18H30O5
Exact Mass 326.209324 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GizHkZHx5dF
Name Diethyl 2-(1-oxaspiro[5.5]undecan-2-ylmethyl)malonate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.209324061 u
Formula C18H30O5
InChI InChI=1S/C18H30O5/c1-3-21-16(19)15(17(20)22-4-2)13-14-9-8-12-18(23-14)10-6-5-7-11-18/h14-15H,3-13H2,1-2H3
InChIKey JPYBIAJAZIXZIQ-UHFFFAOYSA-N
Molecular Weight 326.433 g/mol
SMILES C12(CCCCC2)OC(CC(C(OCC)=O)C(OCC)=O)CCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.980917