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2-(2-methylprop-1-en-1-yl)-5,5-diphenyloxane
SpectraBase Compound ID E1RJydhhHpW
InChI InChI=1S/C21H24O/c1-17(2)15-20-13-14-21(16-22-20,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,15,20H,13-14,16H2,1-2H3
InChIKey FLOGIGFZGLMSDA-UHFFFAOYSA-N
Mol Weight 292.42 g/mol
Molecular Formula C21H24O
Exact Mass 292.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUAt7UO1iQm
Name 2-(2-methylprop-1-en-1-yl)-5,5-diphenyloxane
Appearance Colorless oil
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Exact Mass 292.182715392 u
Formula C21H24O
InChI InChI=1S/C21H24O/c1-17(2)15-20-13-14-21(16-22-20,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,15,20H,13-14,16H2,1-2H3
InChIKey FLOGIGFZGLMSDA-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201502160
Optical Rotation [a]D20 = +206.2 (c = 1.3, CHCl3)
Quality 210
Reported Formula C21H24O
SMILES C1(CCC(CO1)(C1=CC=CC=C1)C1=CC=CC=C1)C=C(C)C
SPLASH splash10-001i-1910000000-5d9eef820baa09c389c1
Sample Comments 98% ee
Source of Spectrum QE-21-SM28-13 (DOI: 10.1002/chem.201502160)
Wiley ID 1909175