SpectraBase Compound ID | LDc4tGUq7uv |
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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 |
SpectraBase Spectrum ID | 1PTwKXawEAL |
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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 |