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3-(6,6-Dimethyl-5-oxohept-2-enyl)-cycloheptanone
SpectraBase Compound ID 2WnDqwQsy62
InChI InChI=1S/C16H26O2/c1-16(2,3)15(18)11-7-5-9-13-8-4-6-10-14(17)12-13/h5,7,13H,4,6,8-12H2,1-3H3/b7-5+
InChIKey YAEMUMFOEJCWFF-FNORWQNLSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GvgsVyFTgF
Name 3-(6,6-DIMETHYL-5-OXOHEPT-2-ENYL)CYCLOHEPTANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-16(2,3)15(18)11-7-5-9-13-8-4-6-10-14(17)12-13/h5,7,13H,4,6,8-12H2,1-3H3/b7-5+
InChIKey YAEMUMFOEJCWFF-FNORWQNLSA-N
Molecular Weight 250.1926
SMILES C1C(=O)CC(C\C=C\CC(C(C)(C)C)=O)CCC1
SPLASH splash10-0a4i-9400000000-451823bf43084327f194
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany