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1-(3-Oxo-1-cyclohexenyl)-2-methylpropyl Acetate
SpectraBase Compound ID BAZfYierFJS
InChI InChI=1S/C12H18O3/c1-8(2)12(15-9(3)13)10-5-4-6-11(14)7-10/h7-8,12H,4-6H2,1-3H3
InChIKey PPUQKSSXIXHWCF-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 Buln2U8BEE8
Name 1-(3-Oxo-1-cyclohexenyl)-2-methylpropyl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8(2)12(15-9(3)13)10-5-4-6-11(14)7-10/h7-8,12H,4-6H2,1-3H3
InChIKey PPUQKSSXIXHWCF-UHFFFAOYSA-N
Molecular Weight 210.273 g/mol
SMILES C1(=CC(=O)CCC1)C(OC(=O)C)C(C)C
SPLASH splash10-004i-0900000000-786bc960d8b906dc2205
Source of Spectrum J-58-596-20
Synonyms 2-Methyl-1-(3-oxo-1-cyclohexen-1-yl)propyl acetate Acetic acid[1-(3-ketocyclohexen-1-yl)-2-methyl-propyl]ester Acetic acid[2-methyl-1-(3-oxo-1-cyclohexenyl)propyl]ester [2-methyl-1-(3-oxidanylidenecyclohexen-1-yl)propyl]ethanoate [2-methyl-1-(3-oxocyclohexen-1-yl)propyl]acetate Acetic acid [2-methyl-1-(3-oxo-1-cyclohexenyl)propyl] ester [2-methyl-1-(3-oxocyclohexen-1-yl)propyl] acetate [2-methyl-1-(3-oxidanylidenecyclohexen-1-yl)propyl] ethanoate
Wiley ID 1209316