(2R,4R)-2-endo-benzoyl-4-exo,7-diphenyl-6,8-dioxy-3,7-diazabicyclo[3.3.0]octane

SpectraBase Compound ID	ANCXM2JXlUp
InChI	InChI=1S/C25H20N2O3/c28-23(17-12-6-2-7-13-17)22-20-19(21(26-22)16-10-4-1-5-11-16)24(29)27(25(20)30)18-14-8-3-9-15-18/h1-15,19-22,26H/t19?,20?,21-,22+/m0/s1
InChIKey	ILDXGCAZDKGMBX-QZNJRLLKSA-N Google Search
Mol Weight	396.45 g/mol
Molecular Formula	C25H20N2O3
Exact Mass	396.147393 g/mol

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SpectraBase Spectrum ID	HPE5fOawSgF
Name	(2R,4R)-2-Endo-benzoyl-4-exo,7-diphenyl-6,8-dioxy-3,7-diazabicyclo[3.3.0]octane
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	396.147392509 u
Formula	C25H20N2O3
InChI	InChI=1S/C25H20N2O3/c28-23(17-12-6-2-7-13-17)22-20-19(21(26-22)16-10-4-1-5-11-16)24(29)27(25(20)30)18-14-8-3-9-15-18/h1-15,19-22,26H/t19?,20?,21-,22+/m0/s1
InChIKey	ILDXGCAZDKGMBX-QZNJRLLKSA-N
Molecular Weight	396.446 g/mol
SMILES	C12C(C(=O)N(C2=O)C=2C=CC=CC2)[C@](C2=CC=CC=C2)(N[C@]1(C(=O)C1=CC=CC=C1)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.94207