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(4S,5S)-5-Methyl-4-(4'-tolylthiocarbonyl)-2-oxo-1-(N-fluoren-9-ylmethyloxycarbonyl)imidazolidinone
SpectraBase Compound ID AHu6J9n0qtU
InChI InChI=1S/C27H24N2O4S/c1-16-11-13-18(14-12-16)34-25(30)24-17(2)29(26(31)28-24)27(32)33-15-23-21-9-5-3-7-19(21)20-8-4-6-10-22(20)23/h3-14,17,23-24H,15H2,1-2H3,(H,28,31)/t17-,24-/m0/s1
InChIKey QTEYKFBUMFKTOY-XDHUDOTRSA-N
Mol Weight 472.56 g/mol
Molecular Formula C27H24N2O4S
Exact Mass 472.145678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2X3f5E5TBAP
Name (4S,5S)-5-Methyl-4-(4'-tolylthiocarbonyl)-2-oxo-1-(N-fluoren-9-ylmethyloxycarbonyl)imidazolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.145678431 u
Formula C27H24N2O4S
InChI InChI=1S/C27H24N2O4S/c1-16-11-13-18(14-12-16)34-25(30)24-17(2)29(26(31)28-24)27(32)33-15-23-21-9-5-3-7-19(21)20-8-4-6-10-22(20)23/h3-14,17,23-24H,15H2,1-2H3,(H,28,31)/t17-,24-/m0/s1
InChIKey QTEYKFBUMFKTOY-XDHUDOTRSA-N
Molecular Weight 472.559 g/mol
SMILES C1(N([C@]([C@](N1)(C(SC1=CC=C(C=C1)C)=O)[H])(C)[H])C(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)=O