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(4S,4'S)-2,2'-(2,2'-oxybis(2,1-phenylene))bis(4-phenyl-4,5-dihydrooxazole)
SpectraBase Compound ID 32uBpl9PNJD
InChI InChI=1S/C30H24N2O3/c1-3-11-21(12-4-1)25-19-33-29(31-25)23-15-7-9-17-27(23)35-28-18-10-8-16-24(28)30-32-26(20-34-30)22-13-5-2-6-14-22/h1-18,25-26H,19-20H2/t25-,26-/m1/s1
InChIKey WBBKXXKVLURHRH-CLJLJLNGSA-N
Mol Weight 460.53 g/mol
Molecular Formula C30H24N2O3
Exact Mass 460.178693 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HPZLpw91NQM
Name (4S,4'S)-2,2'-(2,2'-Oxybis(2,1-phenylene))bis(4-phenyl-4,5-dihydrooxazole)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 460.178692638 u
Formula C30H24N2O3
InChI InChI=1S/C30H24N2O3/c1-3-11-21(12-4-1)25-19-33-29(31-25)23-15-7-9-17-27(23)35-28-18-10-8-16-24(28)30-32-26(20-34-30)22-13-5-2-6-14-22/h1-18,25-26H,19-20H2/t25-,26-/m1/s1
InChIKey WBBKXXKVLURHRH-CLJLJLNGSA-N
Molecular Weight 460.533 g/mol
SMILES C=1C=CC(OC2=C(C=CC=C2)C2=N[C@](CO2)(C2=CC=CC=C2)[H])=C(C2=N[C@](CO2)(C2=CC=CC=C2)[H])C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.860339