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2,2-Bis(4-fluorophenyl)-6-({[(9H-fluoren-9-yl)methoxycarbonyl]amino}methyl)-2H-1-benzopyran
SpectraBase Compound ID ENpR4aimmAO
InChI InChI=1S/C37H27F2NO3/c38-28-14-10-26(11-15-28)37(27-12-16-29(39)17-13-27)20-19-25-21-24(9-18-35(25)43-37)22-40-36(41)42-23-34-32-7-3-1-5-30(32)31-6-2-4-8-33(31)34/h1-21,34H,22-23H2,(H,40,41)
InChIKey ODABEHOBHNARML-UHFFFAOYSA-N
Mol Weight 571.6 g/mol
Molecular Formula C37H27F2NO3
Exact Mass 571.1959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpDAl1k6ryn
Name 2,2-Bis(4-fluorophenyl)-6-({[(9H-fluoren-9-yl)methoxycarbonyl]amino}methyl)-2H-1-benzopyran
Appearance Colorless solid
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Formula C37H27F2NO3
InChI InChI=1S/C37H27F2NO3/c38-28-14-10-26(11-15-28)37(27-12-16-29(39)17-13-27)20-19-25-21-24(9-18-35(25)43-37)22-40-36(41)42-23-34-32-7-3-1-5-30(32)31-6-2-4-8-33(31)34/h1-21,34H,22-23H2,(H,40,41)
InChIKey ODABEHOBHNARML-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95 SQ
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.5.25
Molecular Weight 571.624 g/mol
Reported Formula C37H27F2NO3
SMILES N(Cc1cc2c(cc1)OC(C=C2)(c1ccc(cc1)F)c1ccc(cc1)F)C(=O)OCC1c2c(-c3c1cccc3)cccc2
SPLASH splash10-004i-0904000000-dcaba6b3e82738829b44
Source of Spectrum BJO-5-SM18-12b
Thin-Layer Chromatography Rf = 0.37 (pentane/dichloromethane, 2:1)
Wiley ID 1871571