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2-[(2-bromanylcyclohexen-1-yl)methyl]-2-(3-oxidanylidenebutyl)cyclohexane-1,3-dione
SpectraBase Compound ID LieRWkaKjU
InChI InChI=1S/C17H23BrO3/c1-12(19)9-10-17(15(20)7-4-8-16(17)21)11-13-5-2-3-6-14(13)18/h2-11H2,1H3
InChIKey SSQZKABMCMXKNA-UHFFFAOYSA-N
Mol Weight 355.27 g/mol
Molecular Formula C17H23BrO3
Exact Mass 354.083058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6x5uYfyaspA
Name 2-[(2-bromanylcyclohexen-1-yl)methyl]-2-(3-oxidanylidenebutyl)cyclohexane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23BrO3
InChI InChI=1S/C17H23BrO3/c1-12(19)9-10-17(15(20)7-4-8-16(17)21)11-13-5-2-3-6-14(13)18/h2-11H2,1H3
InChIKey SSQZKABMCMXKNA-UHFFFAOYSA-N
Molecular Weight 355.272 g/mol
SMILES C1(CC2=C(Br)CCCC2)(C(=O)CCCC1=O)CCC(=O)C
SPLASH splash10-004l-9230000000-0b3a4e2b22ef26cd9831
Source of Spectrum SK-24-285-5
Synonyms 2-[(2-bromo-1-cyclohexenyl)methyl]-2-(3-oxobutyl)cyclohexane-1,3-dione 2-[(2-bromocyclohexen-1-yl)methyl]-2-(3-ketobutyl)cyclohexane-1,3-quinone 2-[(2-bromocyclohexen-1-yl)methyl]-2-(3-oxobutyl)cyclohexane-1,3-dione
Wiley ID 866070