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NIFALSQHDPEDDL-OTSXPSDFSA-N

View entire compound with spectra: 3 NMR

NIFALSQHDPEDDL-OTSXPSDFSA-N
SpectraBase Compound ID FhEzKdfQaUy
InChI InChI=1S/C14H18O2/c1-10(9-15)5-6-13-11(2)7-12(16)8-14(13,3)4/h5-7,9H,8H2,1-4H3/b10-5+,13-6+
InChIKey NIFALSQHDPEDDL-OTSXPSDFSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GsOqBbd3aEU
Name 4-(3-trans-Formyl-2-butenylidene)-3,5,5-trimethyl-cyclohex-2-enone
CAS Registry Number 71608-89-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-10(9-15)5-6-13-11(2)7-12(16)8-14(13,3)4/h5-7,9H,8H2,1-4H3/b10-5+,13-6+
InChIKey NIFALSQHDPEDDL-OTSXPSDFSA-N
Instrument Name Bruker HX-90
Literature Reference G. Englert, Helv. Chim. Acta 58, 2367 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3