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5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl 2-hydroxy-2-methylpent-4-enoate

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5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl 2-hydroxy-2-methylpent-4-enoate
SpectraBase Compound ID 8eyiij8yM60
InChI InChI=1S/C22H32O3/c1-6-14-22(5,24)20(23)25-19-15-16(2)12-13-18(19)21(3,4)17-10-8-7-9-11-17/h6-11,16,18-19,24H,1,12-15H2,2-5H3
InChIKey FRFXIOLMOSNYHT-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNHsWJv89ac
Name 5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl 2-hydroxy-2-methylpent-4-enoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.235144887 u
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-6-14-22(5,24)20(23)25-19-15-16(2)12-13-18(19)21(3,4)17-10-8-7-9-11-17/h6-11,16,18-19,24H,1,12-15H2,2-5H3
InChIKey FRFXIOLMOSNYHT-UHFFFAOYSA-N
Molecular Weight 344.495 g/mol
SMILES C(C(CC=C)(C)O)(=O)OC1C(CCC(C1)C)C(C)(C=1C=CC=CC1)C