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7-Oxabicyclo[4.1.0]heptan-2-one, 4,4,6-trimethyl-
SpectraBase Compound ID jlaupSDdND
InChI InChI=1S/C9H14O2/c1-8(2)4-6(10)7-9(3,5-8)11-7/h7H,4-5H2,1-3H3
InChIKey ROTNQFPVXVZSRL-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsjOc55Gp6n
Name 7-Oxabicyclo[4.1.0]heptan-2-one, 4,4,6-trimethyl-
Alternate Name(s) 2,3-Epoxy-3,5,5-trimethyl-1-cyclohexanone 4,4,6-Trimethyl-7-oxabicyclo[4.1.0]heptan-2-one 2,3-Epoxy-3,5,5-trimethylcyclohexanone Isophorone epoxide
CAS Registry Number 10276-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-8(2)4-6(10)7-9(3,5-8)11-7/h7H,4-5H2,1-3H3
InChIKey ROTNQFPVXVZSRL-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES C12(OC2C(=O)CC(C1)(C)C)C
SPLASH splash10-05o0-9200000000-cb03882765b10c68aada
Source of Spectrum K1-2000-1910-1
Wiley ID 750246