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3,5,5-Trimethyl-6-methoxycarbonyl-2-cyclohexenone
SpectraBase Compound ID LDc4tGUq7uv
InChI InChI=1S/C11H16O3/c1-7-5-8(12)9(10(13)14-4)11(2,3)6-7/h5,9H,6H2,1-4H3
InChIKey DVRUDYWXVMIYKQ-UHFFFAOYSA-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 1PTwKXawEAL
Name 3,5,5-Trimethyl-6-methoxycarbonyl-2-cyclohexenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-7-5-8(12)9(10(13)14-4)11(2,3)6-7/h5,9H,6H2,1-4H3
InChIKey DVRUDYWXVMIYKQ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 196.246 g/mol
SMILES COC(=O)C1C(=O)C=C(CC1(C)C)C
SPLASH splash10-001i-9400000000-0ebd061e339ae19aa51c
Source of Spectrum SRH-2022-4762-0
Wiley ID 1826893