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2-Cyclohexen-1-one, 3,5,5-trimethyl-2-(2-propenyl)-
SpectraBase Compound ID 7xstf1gpy8d
InChI InChI=1S/C12H18O/c1-5-6-10-9(2)7-12(3,4)8-11(10)13/h5H,1,6-8H2,2-4H3
InChIKey FVUNTBDGUHBYRC-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GITC2yglrTD
Name 2-Cyclohexen-1-one, 3,5,5-trimethyl-2-(2-propenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.135765199 u
Formula C12H18O
InChI InChI=1S/C12H18O/c1-5-6-10-9(2)7-12(3,4)8-11(10)13/h5H,1,6-8H2,2-4H3
InChIKey FVUNTBDGUHBYRC-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C(C=C)C1=C(C)CC(CC1=O)(C)C