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3-hydroxy-5,5-dimethyl-2-(2-methyloxolan-2-yl)cyclohex-2-en-1-one
SpectraBase Compound ID BU2kLcKw8Vp
InChI InChI=1S/C13H20O3/c1-12(2)7-9(14)11(10(15)8-12)13(3)5-4-6-16-13/h14H,4-8H2,1-3H3
InChIKey SPRULCBPWOSADL-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52AvqlN8DxY
Name 3-Hydroxy-5,5-dimethyl-2-(2-methyl-2-oxolanyl)-1-cyclohex-2-enone
CAS Registry Number 118096-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-12(2)7-9(14)11(10(15)8-12)13(3)5-4-6-16-13/h14H,4-8H2,1-3H3
InChIKey SPRULCBPWOSADL-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES OC1=C(C(CC(C)(C)C1)=O)C1(OCCC1)C
SPLASH splash10-001i-9110000000-3930fc626e2f2dd0fed5
Source of Spectrum B-41-334-9
Synonyms 3-Hydroxy-5,5-dimethyl-2-(2-methyloxolan-2-yl)cyclohex-2-en-1-one 3-Hydroxy-5,5-dimethyl-2-(2-methyltetrahydrofuran-2-yl)cyclohex-2-en-1-one 5,5-Dimethyl-2-(2-methyloxolan-2-yl)-3-oxidanyl-cyclohex-2-en-1-one
Wiley ID 1225277