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2-Cyclohexen-1-one, 3-[(acetyloxy)methyl]-6-(1-methylethyl)-
SpectraBase Compound ID sbKEicADWJ
InChI InChI=1S/C12H18O3/c1-8(2)11-5-4-10(6-12(11)14)7-15-9(3)13/h6,8,11H,4-5,7H2,1-3H3
InChIKey HJZUEQSIDSRXFD-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91XALjvR2yY
Name 2-Cyclohexen-1-one, 3-[(acetyloxy)methyl]-6-(1-methylethyl)-
Alternate Name(s) (4-Isopropyl-3-oxo-1-cyclohexen-1-yl)methyl acetate (3-oxidanylidene-4-propan-2-yl-cyclohexen-1-yl)methyl ethanoate (3-oxo-4-propan-2-ylcyclohexen-1-yl)methyl acetate (4-isopropyl-3-oxo-cyclohexen-1-yl)methyl acetate Acetic acid (3-oxo-4-propan-2-yl-1-cyclohexenyl)methyl ester Acetic acid (4-isopropyl-3-keto-cyclohexen-1-yl)methyl ester
CAS Registry Number 56248-42-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8(2)11-5-4-10(6-12(11)14)7-15-9(3)13/h6,8,11H,4-5,7H2,1-3H3
InChIKey HJZUEQSIDSRXFD-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES CC(C)C1C(=O)C=C(CC1)COC(C)=O
SPLASH splash10-0a4l-7900000000-d7f12302d284be79a14a
Source of Spectrum B-26-854-20
Wiley ID 1209146