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Acetic acid (1S,6S)-6-acetyl-3-methyl-cyclohex-3-enyl ester
SpectraBase Compound ID GohhECWkGdV
InChI InChI=1S/C11H16O3/c1-7-4-5-10(8(2)12)11(6-7)14-9(3)13/h4,10-11H,5-6H2,1-3H3/t10-,11+/m1/s1
InChIKey XCXCEBSNMOTXOL-MNOVXSKESA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7xAPDOHzQF
Name Acetic acid (1S,6S)-6-acetyl-3-methyl-cyclohex-3-enyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-7-4-5-10(8(2)12)11(6-7)14-9(3)13/h4,10-11H,5-6H2,1-3H3/t10-,11+/m1/s1
InChIKey XCXCEBSNMOTXOL-MNOVXSKESA-N
Molecular Weight 196.246 g/mol
SMILES [C@@]1([C@](CC=C(C1)C)(C(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9500000000-65cda84f3b7322214e6c
Source of Spectrum QC-17-794-4
Synonyms (1RS,6RS)-6-Acetyl-3-methyl-1-acetylcyclohex-3-ene (1S,6S)-6-acetyl-3-methyl-3-cyclohexen-1-yl acetate Acetic acid [(1S,6S)-6-acetyl-3-methyl-1-cyclohex-3-enyl] ester [(1S,6S)-6-acetyl-3-methylcyclohex-3-en-1-yl] acetate [(1S,6S)-6-acetyl-3-methyl-cyclohex-3-en-1-yl] acetate [(1S,6S)-6-ethanoyl-3-methyl-cyclohex-3-en-1-yl] ethanoate
Wiley ID 1638183