Anti-trimethyl 3-methyl-8-phenyl-1,2-diazabicyclo[3.3.0]octane-3,6,6-tricarboxylate

SpectraBase Compound ID	D8vUIOmkDil
InChI	InChI=1S/C19H24N2O6/c1-18(15(22)25-2)11-14-19(16(23)26-3,17(24)27-4)10-13(21(14)20-18)12-8-6-5-7-9-12/h5-9,13-14,20H,10-11H2,1-4H3/t13-,14+,18?/m0/s1
InChIKey	CLURDCUQUHTZGX-BWLUYJDISA-N Google Search
Mol Weight	376.41 g/mol
Molecular Formula	C19H24N2O6
Exact Mass	376.163436 g/mol

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SpectraBase Spectrum ID	8Udw5tuOJz2
Name	Anti-trimethyl 3-methyl-8-phenyl-1,2-diazabicyclo[3.3.0]octane-3,6,6-tricarboxylate
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	376.163436495 u
Formula	C19H24N2O6
InChI	InChI=1S/C19H24N2O6/c1-18(15(22)25-2)11-14-19(16(23)26-3,17(24)27-4)10-13(21(14)20-18)12-8-6-5-7-9-12/h5-9,13-14,20H,10-11H2,1-4H3/t13-,14+,18?/m0/s1
InChIKey	CLURDCUQUHTZGX-BWLUYJDISA-N
Molecular Weight	376.409 g/mol
SMILES	[C@]12(N([C@@](CC2(C(=O)OC)C(=O)OC)(C2=CC=CC=C2)[H])NC(C1)(C(=O)OC)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.923962