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Methyl (4S*,1R*,3R*)-4-hydroxy-3-phenylcyclohexanecarboxylate
SpectraBase Compound ID 3jF27dUfwHN
InChI InChI=1S/C14H18O3/c1-17-14(16)11-7-8-13(15)12(9-11)10-5-3-2-4-6-10/h2-6,11-13,15H,7-9H2,1H3/t11-,12-,13+/m1/s1
InChIKey LRWOHBTZIVZOBS-UPJWGTAASA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ko6ciZcQbR
Name Methyl (4S*,1R*,3R*)-4-hydroxy-3-phenylcyclohexanecarboxylate
Alternate Name(s) Methyl (1R,3R,4S)-4-hydroxy-3-phenylcyclohexanecarboxylate
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Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-17-14(16)11-7-8-13(15)12(9-11)10-5-3-2-4-6-10/h2-6,11-13,15H,7-9H2,1H3/t11-,12-,13+/m1/s1
InChIKey LRWOHBTZIVZOBS-UPJWGTAASA-N
Molecular Weight 234.295 g/mol
SMILES O[C@@]1([C@](C[C@](C(=O)OC)(CC1)[H])(c1ccccc1)[H])[H]
SPLASH splash10-0udi-2910000000-3efc5f4689cb43b81af5
Source of Spectrum KC-0-506-5
Wiley ID 824381