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5,6,6-trimethyl-2-oxanone

View entire compound with spectra: 1 MS (GC)

5,6,6-trimethyl-2-oxanone
SpectraBase Compound ID 2r8Lffgul9k
InChI InChI=1S/C8H14O2/c1-6-4-5-7(9)10-8(6,2)3/h6H,4-5H2,1-3H3
InChIKey FAOBJPSMUKCXQK-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFfp6PqRXNh
Name 5,6,6-trimethyl-2-oxanone
Alternate Name(s) 5,6,6-trimethyloxan-2-one 5,6,6-trimethyltetrahydropyran-2-one
CAS Registry Number 28525-60-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-6-4-5-7(9)10-8(6,2)3/h6H,4-5H2,1-3H3
InChIKey FAOBJPSMUKCXQK-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
SMILES C1(OC(CCC1C)=O)(C)C
SPLASH splash10-0a4l-9000000000-e70ae44e30d0184b083b
Source of Spectrum F-34-1239-0
Wiley ID 1141127