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(5E)-5-tert-Pentyloct-5-en-2-one
SpectraBase Compound ID BJYXObAc4RS
InChI InChI=1S/C13H24O/c1-6-8-12(10-9-11(3)14)13(4,5)7-2/h8H,6-7,9-10H2,1-5H3/b12-8+
InChIKey VCTUSGSGXVXMHH-XYOKQWHBSA-N
Mol Weight 196.33 g/mol
Molecular Formula C13H24O
Exact Mass 196.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8QH1JjJMCR
Name (5E)-5-tert-Pentyloct-5-en-2-one
Alternate Name(s) (E)-5-(2-methylbutan-2-yl)-5-octen-2-one (E)-5-(1,1-dimethylpropyl)oct-5-en-2-one (E)-5-(2-methylbutan-2-yl)oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O
InChI InChI=1S/C13H24O/c1-6-8-12(10-9-11(3)14)13(4,5)7-2/h8H,6-7,9-10H2,1-5H3/b12-8+
InChIKey VCTUSGSGXVXMHH-XYOKQWHBSA-N
Molecular Weight 196.334 g/mol
SMILES CC(CC\C(=C/CC)C(CC)(C)C)=O
SPLASH splash10-0a4l-9600000000-ba94f31f6a87ad42e20a
Source of Spectrum F4-44-2993-39
Wiley ID 1716906