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(3E)-4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-one

View entire compound with spectra: 32 NMR, 12 FTIR, 2 Raman, 39 MS (GC), and 2 Near IR

(3E)-4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
SpectraBase Compound ID 4yPnJHEWQos
InChI InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
InChIKey UZFLPKAIBPNNCA-BQYQJAHWSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnudVAfFKn8
Name 4-(2,6,6-TRIMETHYLCYCLOHEX-2-ENYL)BUT-3-EN-2-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
InChIKey UZFLPKAIBPNNCA-BQYQJAHWSA-N
Molecular Weight 192.1509
SMILES C1(CCC=C(C1\C=C\C(C)=O)C)(C)C
SPLASH splash10-0006-9800000000-9f3f13e5ab1393092de8
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany