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3-CARBETHOXYMETHYL-2-CYCLOHEXEN-1-ONE

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3-CARBETHOXYMETHYL-2-CYCLOHEXEN-1-ONE
SpectraBase Compound ID 86qOGxCSg6e
InChI InChI=1S/C10H14O3/c1-2-13-10(12)7-8-4-3-5-9(11)6-8/h6H,2-5,7H2,1H3
InChIKey VRPDZGGFNUXHFQ-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Y3BBOMSM7z
Name Ethyl 2-(3-oxocyclohex-1-enyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-2-13-10(12)7-8-4-3-5-9(11)6-8/h6H,2-5,7H2,1H3
InChIKey VRPDZGGFNUXHFQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201800299
Molecular Weight 182.219 g/mol
SMILES C1CC(=CC(C1)=O)CC(OCC)=O
SPLASH splash10-000t-5900000000-17e6a69dea1faa935fee
Source of Spectrum ASC-360-SM20-9b
Synonyms Ethyl 2-(3-oxocyclohex-1-en-1-yl)acetate
Wiley ID 1812159