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2-(1-Oxoheptyl)-2-phenylcyclohexan-1-ol
SpectraBase Compound ID KCWwY6WYVHb
InChI InChI=1S/C19H28O2/c1-2-3-4-8-13-17(20)19(15-10-9-14-18(19)21)16-11-6-5-7-12-16/h5-7,11-12,18,21H,2-4,8-10,13-15H2,1H3/t18-,19+/m0/s1
InChIKey ULRSAFHQJSYFKL-RBUKOAKNSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Ig7oXDIqEn
Name 2-(1-Oxoheptyl)-2-phenylcyclohexan-1-ol
Alternate Name(s) 1-((1S,2S)-2-Hydroxy-1-phenyl-cyclohexyl)-heptan-1-one 1-(2-hydroxy-1-phenylcyclohexyl)-1-heptanone
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Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-2-3-4-8-13-17(20)19(15-10-9-14-18(19)21)16-11-6-5-7-12-16/h5-7,11-12,18,21H,2-4,8-10,13-15H2,1H3/t18-,19+/m0/s1
InChIKey ULRSAFHQJSYFKL-RBUKOAKNSA-N
Molecular Weight 288.431 g/mol
SMILES O[C@@]1([C@@](C(=O)CCCCCC)(c2ccccc2)CCCC1)[H]
SPLASH splash10-0a4l-5920000000-fd630eed11c08231688d
Source of Spectrum J-58-5951-3
Wiley ID 1292117