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1-Methoxy-4-(((2S,4R)-4-methylhept-5-in-2-yl)oxy)benzene
SpectraBase Compound ID CZOLq3NMrD7
InChI InChI=1S/C15H20O2/c1-5-6-12(2)11-13(3)17-15-9-7-14(16-4)8-10-15/h7-10,12-13H,11H2,1-4H3/t12-,13-/m0/s1
InChIKey LVDCWACZBVPLQM-STQMWFEESA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PuxpLxVPtA
Name 1-Methoxy-4-(((2S,4R)-4-methylhept-5-in-2-yl)oxy)benzene
Appearance Colorless oil
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Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-5-6-12(2)11-13(3)17-15-9-7-14(16-4)8-10-15/h7-10,12-13H,11H2,1-4H3/t12-,13-/m0/s1
InChIKey LVDCWACZBVPLQM-STQMWFEESA-N
Instrument Name Finnigan MAT 95 XL
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.53
Molecular Weight 232.323 g/mol
Optical Rotation [a]D26 = +34.7 (c = 1.09, CHCl3)
Reported Formula C15H20O2
SMILES c1(ccc(cc1)OC)O[C@](C[C@](C#CC)(C)[H])(C)[H]
SPLASH splash10-00di-1910000000-11e66d2b1ee1cb241d4a
Source of Spectrum BJO-15-SM12-17
Thin-Layer Chromatography Rf = 0.51
Wiley ID 1841007