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trans-3-(p-Chlorobenzyl)-1,3,5,5-tetramethylcyclohexan-1-ol
SpectraBase Compound ID BixDc9ti3mO
InChI InChI=1S/C17H25ClO/c1-15(2)10-16(3,12-17(4,19)11-15)9-13-5-7-14(18)8-6-13/h5-8,19H,9-12H2,1-4H3/t16-,17+/m0/s1
InChIKey CMAYVEVXVQXHKI-DLBZAZTESA-N
Mol Weight 280.84 g/mol
Molecular Formula C17H25ClO
Exact Mass 280.159393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bZliNfDfCX
Name trans-3-(p-Chlorobenzyl)-1,3,5,5-tetramethylcyclohexan-1-ol
Alternate Name(s) (1R,3R)-3-(4-chlorobenzyl)-1,3,5,5-tetramethylcyclohexanol
CAS Registry Number 58240-99-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25ClO
InChI InChI=1S/C17H25ClO/c1-15(2)10-16(3,12-17(4,19)11-15)9-13-5-7-14(18)8-6-13/h5-8,19H,9-12H2,1-4H3/t16-,17+/m0/s1
InChIKey CMAYVEVXVQXHKI-DLBZAZTESA-N
Molecular Weight 280.839 g/mol
SMILES O[C@]1(C[C@](CC(C1)(C)C)(Cc1ccc(cc1)Cl)C)C
SPLASH splash10-000m-9500000000-89098d1994e4ce5bb809
Source of Spectrum J-41-1528-0
Wiley ID 1284151