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(1R*,2R*,3S*,1'R*) 2-(1-Hydroxyethyl)-3-ethylcyclopropyl-1-phenyl Ketone
SpectraBase Compound ID FdAeUeZ9zv2
InChI InChI=1S/C14H18O2/c1-3-11-12(9(2)15)13(11)14(16)10-7-5-4-6-8-10/h4-9,11-13,15H,3H2,1-2H3/t9-,11+,12-,13-/m1/s1
InChIKey GDKDSHCMGFYOOC-GWNIPJSYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fyaf5VN7c5v
Name (1R*,2R*,3S*,1'R*) 2-(1-Hydroxyethyl)-3-ethylcyclopropyl-1-phenyl Ketone
Alternate Name(s) ((1R,2S,3R)-2-ethyl-3-((R)-1-hydroxyethyl)cyclopropyl)(phenyl)methanone [(1R,2S,3R)-2-ethyl-3-[(1R)-1-hydroxyethyl]cyclopropyl]-phenylmethanone [(1R,2S,3R)-2-ethyl-3-[(1R)-1-oxidanylethyl]cyclopropyl]-phenyl-methanone
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Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-11-12(9(2)15)13(11)14(16)10-7-5-4-6-8-10/h4-9,11-13,15H,3H2,1-2H3/t9-,11+,12-,13-/m1/s1
InChIKey GDKDSHCMGFYOOC-GWNIPJSYSA-N
Literature Reference DOI 10.1021/jo402075d
Molecular Weight 218.296 g/mol
SMILES O[C@@]([C@]1([C@](C(=O)c2ccccc2)([C@]1(CC)[H])[H])[H])(C)[H]
SPLASH splash10-0ab9-2900000000-e46834e8b0b1127ee8dd
Source of Spectrum J-78-12435-10b
Wiley ID 1747331