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2-Butanone, 3,3-dimethyl-1-(tetrahydro-6,6-dimethyl-2H-pyran-2-yl)-

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

2-Butanone, 3,3-dimethyl-1-(tetrahydro-6,6-dimethyl-2H-pyran-2-yl)-
SpectraBase Compound ID CZlTWJFnfb9
InChI InChI=1S/C13H24O2/c1-12(2,3)11(14)9-10-7-6-8-13(4,5)15-10/h10H,6-9H2,1-5H3
InChIKey YWWMDKOWDOMLDL-UHFFFAOYSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LqmADo13n6B
Name 2-Butanone, 3,3-dimethyl-1-(tetrahydro-6,6-dimethyl-2H-pyran-2-yl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.177630011 u
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-12(2,3)11(14)9-10-7-6-8-13(4,5)15-10/h10H,6-9H2,1-5H3
InChIKey YWWMDKOWDOMLDL-UHFFFAOYSA-N
Molecular Weight 212.333 g/mol
SMILES C(CC1OC(C)(C)CCC1)(C(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968638