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2-Cyclohexen-1-one, 5-hydroxy-2,4,4-trimethyl-3-(3-oxobutyl)-
SpectraBase Compound ID C8ppG4WS7zO
InChI InChI=1S/C13H20O3/c1-8(14)5-6-10-9(2)11(15)7-12(16)13(10,3)4/h12,16H,5-7H2,1-4H3
InChIKey BUVVDHHPPBQKBC-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 JyK9WLHaMna
Name 2-Cyclohexen-1-one, 5-hydroxy-2,4,4-trimethyl-3-(3-oxobutyl)-
CAS Registry Number 83646-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-8(14)5-6-10-9(2)11(15)7-12(16)13(10,3)4/h12,16H,5-7H2,1-4H3
InChIKey BUVVDHHPPBQKBC-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES OC1CC(C(=C(C1(C)C)CCC(=O)C)C)=O
SPLASH splash10-052k-1910000000-cd92826cd59289899d4c
Source of Spectrum H-65-1600-0
Synonyms 2-Hydroxy-4-oxo-7,8-dihydro-.beta.-ionone 5-Hydroxy-2,4,4-trimethyl-3-(3-oxobutyl)-2-cyclohexen-1-one
Wiley ID 1225225