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5-(2,2-Dimethylpropyl)-5-methyl-3-methylene-2-oxolanone

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

5-(2,2-Dimethylpropyl)-5-methyl-3-methylene-2-oxolanone
SpectraBase Compound ID 1Vu1GzblSFL
InChI InChI=1S/C11H18O2/c1-8-6-11(5,13-9(8)12)7-10(2,3)4/h1,6-7H2,2-5H3
InChIKey ZPSNUBGAVYBBSC-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hny5uxVaG9G
Name 5-(2,2-Dimethylpropyl)-5-methyl-3-methylene-2-oxolanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-8-6-11(5,13-9(8)12)7-10(2,3)4/h1,6-7H2,2-5H3
InChIKey ZPSNUBGAVYBBSC-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES C1(OC(CC(C)(C)C)(C)CC1=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.993082