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2-(2-[(2,6-Difluorobenzyl)oxy]-4-methyl-3-cyclohexen-1-yl)-2-propanol

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2-(2-[(2,6-Difluorobenzyl)oxy]-4-methyl-3-cyclohexen-1-yl)-2-propanol
SpectraBase Compound ID 4A4ftF9gUfT
InChI InChI=1S/C17H22F2O2/c1-11-7-8-13(17(2,3)20)16(9-11)21-10-12-14(18)5-4-6-15(12)19/h4-6,9,13,16,20H,7-8,10H2,1-3H3
InChIKey KQBCCDJGLZATBE-UHFFFAOYSA-N
Mol Weight 296.36 g/mol
Molecular Formula C17H22F2O2
Exact Mass 296.158786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IgpX5J8znu9
Name [1-Methyl-4-(1-hydroxy-1-methyl)ethyl-cyclohex-1-en-3-yl] [2,6-difluorobenzyl] ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.158786272 u
Formula C17H22F2O2
InChI InChI=1S/C17H22F2O2/c1-11-7-8-13(17(2,3)20)16(9-11)21-10-12-14(18)5-4-6-15(12)19/h4-6,9,13,16,20H,7-8,10H2,1-3H3
InChIKey KQBCCDJGLZATBE-UHFFFAOYSA-N
Molecular Weight 296.358 g/mol
SMILES CC(C)(O)C1C(OCC=2C(F)=CC=CC2F)C=C(CC1)C