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4-(1,1-Dimethyl-4-formylbutyl)-3-cyclohexen-1-one
SpectraBase Compound ID L87hZSxxtnb
InChI InChI=1S/C13H20O2/c1-13(2,9-3-4-10-14)11-5-7-12(15)8-6-11/h5,10H,3-4,6-9H2,1-2H3
InChIKey LUVBIPTUASQUJM-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iYXclqiRg7
Name 4-(1,1-Dimethyl-4-formylbutyl)-3-cyclohexen-1-one
Alternate Name(s) 5-Methyl-5-(4-oxo-1-cyclohexen-1-yl)hexanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-13(2,9-3-4-10-14)11-5-7-12(15)8-6-11/h5,10H,3-4,6-9H2,1-2H3
InChIKey LUVBIPTUASQUJM-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES C1(=CCC(CC1)=O)C(CCCC=O)(C)C
SPLASH splash10-000i-0910000000-587dc95814c66a2c6f21
Source of Spectrum F-47-2159-10
Wiley ID 1207300