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(2R*,3R*)-2,8-Dimethyl-3-phenyl-2,3-dihydrocyclopenta[c]chromen-1(4H)-one
SpectraBase Compound ID KFl6cRiLBrA
InChI InChI=1S/C20H18O2/c1-12-8-9-17-15(10-12)19-16(11-22-17)18(13(2)20(19)21)14-6-4-3-5-7-14/h3-10,13,18H,11H2,1-2H3/t13-,18-/m1/s1
InChIKey AGNOEWVJPWEFFN-FZKQIMNGSA-N
Mol Weight 290.36 g/mol
Molecular Formula C20H18O2
Exact Mass 290.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Tlz0jnurZB
Name (2R*,3R*)-2,8-Dimethyl-3-phenyl-2,3-dihydrocyclopenta[c]chromen-1(4H)-one
Appearance Colorless solid
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Exact Mass 290.130679818 u
Formula C20H18O2
InChI InChI=1S/C20H18O2/c1-12-8-9-17-15(10-12)19-16(11-22-17)18(13(2)20(19)21)14-6-4-3-5-7-14/h3-10,13,18H,11H2,1-2H3/t13-,18-/m1/s1
InChIKey AGNOEWVJPWEFFN-FZKQIMNGSA-N
Instrument Name Agilent 6890N/5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.202207406
Molecular Weight 290.362 g/mol
Quality 58
Reported Formula C20H18O2
SMILES C12=C(C3=C(CO2)[C@]([C@](C3=O)(C)[H])(C2=CC=CC=C2)[H])C=C(C=C1)C
SPLASH splash10-0006-0590000000-356c5939979c7a10018e
Source of Spectrum ACI-61-SM28-cis-2z (DOI: 10.1002/anie.202207406)
Thin-Layer Chromatography 0.48 (hexane/EtOAc, 5:1)
Wiley ID 1897941