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6,6'-Bis{1-[(4S,4'S)-4-benzyl-4,5-dihydrooxazol-2-yl]-1-methylethyl}[2,2']bipyridinyl
SpectraBase Compound ID FJze5VBv4f4
InChI InChI=1S/C36H38N4O2/c1-35(2,33-37-27(23-41-33)21-25-13-7-5-8-14-25)31-19-11-17-29(39-31)30-18-12-20-32(40-30)36(3,4)34-38-28(24-42-34)22-26-15-9-6-10-16-26/h5-20,27-28H,21-24H2,1-4H3/t27-,28-/m0/s1
InChIKey LTILSACXDMXEPM-NSOVKSMOSA-N
Mol Weight 558.7 g/mol
Molecular Formula C36H38N4O2
Exact Mass 558.299476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtqUo4o02KK
Name 6,6'-Bis{1-[(4S,4'S)-4-benzyl-4,5-dihydrooxazol-2-yl]-1-methylethyl}[2,2']bipyridinyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H38N4O2
InChI InChI=1S/C36H38N4O2/c1-35(2,33-37-27(23-41-33)21-25-13-7-5-8-14-25)31-19-11-17-29(39-31)30-18-12-20-32(40-30)36(3,4)34-38-28(24-42-34)22-26-15-9-6-10-16-26/h5-20,27-28H,21-24H2,1-4H3/t27-,28-/m0/s1
InChIKey LTILSACXDMXEPM-NSOVKSMOSA-N
Molecular Weight 558.726 g/mol
SMILES C1(C(c2nc(-c3nc(C(C4=N[C@@](Cc5ccccc5)(CO4)[H])(C)C)ccc3)ccc2)(C)C)=N[C@@](Cc2ccccc2)(CO1)[H]
SPLASH splash10-014l-4033900000-7605b6297eb7b5c09a2f
Source of Spectrum KD-13-164-1
Synonyms (4S)-4-benzyl-2-{2-[6-(6-{2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl}pyridin-2-yl)pyridin-2-yl]propan-2-yl}-4,5-dihydro-1,3-oxazole
Wiley ID 1634987