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Benzeneethanol, .alpha.-phenyl-, benzoate
SpectraBase Compound ID DylBFo8tetq
InChI InChI=1S/C21H18O2/c22-21(19-14-8-3-9-15-19)23-20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-15,20H,16H2
InChIKey ZKMUFSPOGMKUJO-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C21H18O2
Exact Mass 302.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3r43ZAT2G4
Name 1,2-diphenylethyl benzoate
Appearance Colorless solid
Carrier Gas Methane
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Exact Mass 302.130679818 u
Formula C21H18O2
InChI InChI=1S/C21H18O2/c22-21(19-14-8-3-9-15-19)23-20(18-12-6-2-7-13-18)16-17-10-4-1-5-11-17/h1-15,20H,16H2
InChIKey ZKMUFSPOGMKUJO-UHFFFAOYSA-N
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.202201761
Quality 78
Reported Formula C21H18O2
SMILES C1(=CC=CC=C1)CC(C1=CC=CC=C1)OC(C1=CC=CC=C1)=O
SPLASH splash10-0a4i-2910000000-f5bdc2ab8831c9d76d47
Source of Spectrum QE-28-5-3a (DOI: 10.1002/chem.202201761)
Thin-Layer Chromatography 0.28 (n-pentane/EtOAc, 40:1)
Wiley ID 1900677