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2-Cyclohexen-1-one, 5-(acetyloxy)-2,4,4-trimethyl-3-(3-oxobutyl)-
SpectraBase Compound ID H1UZyXkceBm
InChI InChI=1S/C15H22O4/c1-9(16)6-7-12-10(2)13(18)8-14(15(12,4)5)19-11(3)17/h14H,6-8H2,1-5H3
InChIKey LWLUMWBSWOHMNU-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C15H22O4
Exact Mass 266.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7GQbzZq9ER
Name 2-Cyclohexen-1-one, 5-(acetyloxy)-2,4,4-trimethyl-3-(3-oxobutyl)-
CAS Registry Number 83646-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4
InChI InChI=1S/C15H22O4/c1-9(16)6-7-12-10(2)13(18)8-14(15(12,4)5)19-11(3)17/h14H,6-8H2,1-5H3
InChIKey LWLUMWBSWOHMNU-UHFFFAOYSA-N
Molecular Weight 266.337 g/mol
SMILES C1(=C(C(=O)CC(C1(C)C)OC(=O)C)C)CCC(=O)C
SPLASH splash10-0c0c-2910000000-00952f0bad1edc43df6e
Source of Spectrum H-65-1601-0
Synonyms 2,2,4-trimethyl-5-oxo-3-(3-oxobutyl)-3-cyclohexen-1-yl acetate 2-Acetoxy-4-oxo-7,8-dihydro-.beta.-ionone
Wiley ID 1270036