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6-ACETOXY-3-ISOPROPYL-6-METHYL-CYCLOHEXA-2,4-DIENONE
SpectraBase Compound ID 6eUQQ42Gy0N
InChI InChI=1S/C12H16O3/c1-8(2)10-5-6-12(4,11(14)7-10)15-9(3)13/h5-8H,1-4H3
InChIKey SDCVYIJDRZGHCH-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZGkqcqbqZV
Name (1-methyl-6-oxidanylidene-4-propan-2-yl-cyclohexa-2,4-dien-1-yl) ethanoate
CAS Registry Number 113105-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-8(2)10-5-6-12(4,11(14)7-10)15-9(3)13/h5-8H,1-4H3
InChIKey SDCVYIJDRZGHCH-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1(C(C=C(C=C1)C(C)C)=O)(OC(=O)C)C
SPLASH splash10-006x-7900000000-e74860c17a40acd1bf15
Source of Spectrum B-40-337-2
Synonyms (1-methyl-6-oxo-4-propan-2-ylcyclohexa-2,4-dien-1-yl) acetate (4-isopropyl-1-methyl-6-oxo-cyclohexa-2,4-dien-1-yl) acetate Acetic acid (1-methyl-6-oxo-4-propan-2-yl-1-cyclohexa-2,4-dienyl) ester Acetic acid (4-isopropyl-6-keto-1-methyl-cyclohexa-2,4-dien-1-yl) ester
Wiley ID 1206932